USER MOD reduce.3.24.130724 H: found=0, std=0, add=1019, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1015 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 TYR OH : rot 34:sc= -2.34! USER MOD Set 1.2: A 40 SER OG : rot 32:sc= 0.144! USER MOD Set 2.1: A 14 GLN : amide:sc= -0.194 K(o=-1.5,f=-0.06) USER MOD Set 2.2: A 133 ASN : amide:sc= -1.35 K(o=-1.5,f=-0.06) USER MOD Single : A 1 MET CE :methyl -127:sc= -4.33! (180deg=-6.53!) USER MOD Single : A 1 MET N :NH3+ 141:sc= 0.0223 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= -0.269 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 90:sc= -1.96! USER MOD Single : A 26 SER OG : rot 139:sc= 0.0486 USER MOD Single : A 29 SER OG : rot 180:sc= -0.132 USER MOD Single : A 36 HIS : no HD1:sc= -3.93! C(o=-3.9!,f=-6.2!) USER MOD Single : A 38 HIS : no HE2:sc= -19.3! C(o=-19!,f=-20!) USER MOD Single : A 43 SER OG : rot 180:sc= -0.289 USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.984 USER MOD Single : A 52 HIS : no HD1:sc= -11.4! C(o=-11!,f=-11!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A 68 TYR OH : rot -26:sc= 1.24 USER MOD Single : A 77 GLN : amide:sc= -0.699 K(o=-0.7,f=-3.9!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 MET CE :methyl 156:sc= 0 (180deg=-0.721) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc= -5.36! C(o=-5.4!,f=-6.5!) USER MOD Single : A 129 ASN : amide:sc= -3.55! C(o=-3.6!,f=-4!) USER MOD Single : A 131 LYS NZ :NH3+ -160:sc= -0.0609 (180deg=-0.136) USER MOD Single : A 143 THR OG1 : rot 111:sc= 0.921 USER MOD Single : A 149 HIS : no HE2:sc= -2.53 X(o=-2.5,f=-2.9!) USER MOD Single : A 151 HIS : no HD1:sc= -5.21! C(o=-5.2!,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.928 -20.056 26.690 1.00 0.00 N ATOM 2 CA MET A 1 4.842 -18.937 26.320 1.00 0.00 C ATOM 3 C MET A 1 4.104 -17.599 26.413 1.00 0.00 C ATOM 4 O MET A 1 2.921 -17.512 26.150 1.00 0.00 O ATOM 5 CB MET A 1 5.253 -19.224 24.875 1.00 0.00 C ATOM 6 CG MET A 1 5.886 -17.971 24.266 1.00 0.00 C ATOM 7 SD MET A 1 7.550 -18.364 23.671 1.00 0.00 S ATOM 8 CE MET A 1 8.168 -16.665 23.588 1.00 0.00 C ATOM 0 H1 MET A 1 4.106 -20.870 26.067 1.00 0.00 H new ATOM 0 H2 MET A 1 4.099 -20.332 27.678 1.00 0.00 H new ATOM 0 H3 MET A 1 2.941 -19.748 26.583 1.00 0.00 H new ATOM 0 HA MET A 1 5.704 -18.870 26.984 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.960 -20.053 24.845 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.383 -19.525 24.291 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.272 -17.603 23.444 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.933 -17.176 25.010 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.575 -16.474 22.595 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.351 -15.971 23.785 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.951 -16.526 24.334 1.00 0.00 H new ATOM 20 N LYS A 2 4.793 -16.555 26.787 1.00 0.00 N ATOM 21 CA LYS A 2 4.130 -15.225 26.897 1.00 0.00 C ATOM 22 C LYS A 2 5.128 -14.108 26.578 1.00 0.00 C ATOM 23 O LYS A 2 6.325 -14.277 26.705 1.00 0.00 O ATOM 24 CB LYS A 2 3.669 -15.131 28.351 1.00 0.00 C ATOM 25 CG LYS A 2 2.260 -14.537 28.403 1.00 0.00 C ATOM 26 CD LYS A 2 1.394 -15.358 29.360 1.00 0.00 C ATOM 27 CE LYS A 2 -0.053 -14.868 29.289 1.00 0.00 C ATOM 28 NZ LYS A 2 -0.712 -15.442 30.496 1.00 0.00 N ATOM 0 H LYS A 2 5.786 -16.566 27.021 1.00 0.00 H new ATOM 0 HA LYS A 2 3.300 -15.119 26.198 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.675 -16.120 28.810 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.358 -14.510 28.923 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.303 -13.500 28.734 1.00 0.00 H new ATOM 0 HG3 LYS A 2 1.818 -14.535 27.407 1.00 0.00 H new ATOM 0 HD2 LYS A 2 1.444 -16.415 29.097 1.00 0.00 H new ATOM 0 HD3 LYS A 2 1.771 -15.265 30.379 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.102 -13.779 29.292 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -0.540 -15.206 28.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -1.710 -15.150 30.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.656 -16.480 30.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -0.231 -15.097 31.351 1.00 0.00 H new ATOM 42 N VAL A 3 4.645 -12.970 26.165 1.00 0.00 N ATOM 43 CA VAL A 3 5.566 -11.843 25.837 1.00 0.00 C ATOM 44 C VAL A 3 6.540 -11.609 26.994 1.00 0.00 C ATOM 45 O VAL A 3 6.169 -11.662 28.149 1.00 0.00 O ATOM 46 CB VAL A 3 4.647 -10.633 25.632 1.00 0.00 C ATOM 47 CG1 VAL A 3 4.936 -9.562 26.688 1.00 0.00 C ATOM 48 CG2 VAL A 3 4.884 -10.047 24.240 1.00 0.00 C ATOM 0 H VAL A 3 3.653 -12.770 26.040 1.00 0.00 H new ATOM 0 HA VAL A 3 6.174 -12.039 24.954 1.00 0.00 H new ATOM 0 HB VAL A 3 3.610 -10.956 25.728 1.00 0.00 H new ATOM 0 HG11 VAL A 3 4.276 -8.709 26.531 1.00 0.00 H new ATOM 0 HG12 VAL A 3 4.764 -9.975 27.682 1.00 0.00 H new ATOM 0 HG13 VAL A 3 5.974 -9.239 26.604 1.00 0.00 H new ATOM 0 HG21 VAL A 3 4.232 -9.186 24.092 1.00 0.00 H new ATOM 0 HG22 VAL A 3 5.924 -9.734 24.149 1.00 0.00 H new ATOM 0 HG23 VAL A 3 4.665 -10.802 23.485 1.00 0.00 H new ATOM 58 N ALA A 4 7.783 -11.348 26.694 1.00 0.00 N ATOM 59 CA ALA A 4 8.770 -11.113 27.784 1.00 0.00 C ATOM 60 C ALA A 4 9.821 -10.094 27.337 1.00 0.00 C ATOM 61 O ALA A 4 9.880 -9.714 26.184 1.00 0.00 O ATOM 62 CB ALA A 4 9.416 -12.476 28.036 1.00 0.00 C ATOM 0 H ALA A 4 8.156 -11.288 25.746 1.00 0.00 H new ATOM 0 HA ALA A 4 8.303 -10.712 28.683 1.00 0.00 H new ATOM 0 HB1 ALA A 4 10.158 -12.386 28.829 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.650 -13.192 28.335 1.00 0.00 H new ATOM 0 HB3 ALA A 4 9.901 -12.823 27.124 1.00 0.00 H new ATOM 68 N LYS A 5 10.653 -9.652 28.239 1.00 0.00 N ATOM 69 CA LYS A 5 11.700 -8.661 27.863 1.00 0.00 C ATOM 70 C LYS A 5 12.866 -9.369 27.168 1.00 0.00 C ATOM 71 O LYS A 5 14.017 -9.153 27.490 1.00 0.00 O ATOM 72 CB LYS A 5 12.158 -8.045 29.186 1.00 0.00 C ATOM 73 CG LYS A 5 12.177 -6.520 29.060 1.00 0.00 C ATOM 74 CD LYS A 5 13.487 -5.976 29.634 1.00 0.00 C ATOM 75 CE LYS A 5 13.785 -4.608 29.016 1.00 0.00 C ATOM 76 NZ LYS A 5 13.152 -3.624 29.938 1.00 0.00 N ATOM 0 H LYS A 5 10.653 -9.934 29.219 1.00 0.00 H new ATOM 0 HA LYS A 5 11.327 -7.906 27.172 1.00 0.00 H new ATOM 0 HB2 LYS A 5 11.487 -8.346 29.991 1.00 0.00 H new ATOM 0 HB3 LYS A 5 13.151 -8.411 29.445 1.00 0.00 H new ATOM 0 HG2 LYS A 5 12.078 -6.230 28.014 1.00 0.00 H new ATOM 0 HG3 LYS A 5 11.328 -6.090 29.592 1.00 0.00 H new ATOM 0 HD2 LYS A 5 13.413 -5.889 30.718 1.00 0.00 H new ATOM 0 HD3 LYS A 5 14.303 -6.667 29.424 1.00 0.00 H new ATOM 0 HE2 LYS A 5 14.858 -4.438 28.933 1.00 0.00 H new ATOM 0 HE3 LYS A 5 13.371 -4.530 28.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 13.313 -2.660 29.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 12.130 -3.807 29.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 13.571 -3.717 30.885 1.00 0.00 H new ATOM 90 N ASP A 6 12.575 -10.215 26.219 1.00 0.00 N ATOM 91 CA ASP A 6 13.665 -10.938 25.506 1.00 0.00 C ATOM 92 C ASP A 6 13.114 -11.660 24.273 1.00 0.00 C ATOM 93 O ASP A 6 13.768 -12.510 23.700 1.00 0.00 O ATOM 94 CB ASP A 6 14.200 -11.947 26.523 1.00 0.00 C ATOM 95 CG ASP A 6 13.097 -12.945 26.881 1.00 0.00 C ATOM 96 OD1 ASP A 6 12.752 -13.746 26.029 1.00 0.00 O ATOM 97 OD2 ASP A 6 12.617 -12.890 28.000 1.00 0.00 O ATOM 0 H ASP A 6 11.630 -10.437 25.906 1.00 0.00 H new ATOM 0 HA ASP A 6 14.442 -10.261 25.151 1.00 0.00 H new ATOM 0 HB2 ASP A 6 15.061 -12.473 26.111 1.00 0.00 H new ATOM 0 HB3 ASP A 6 14.542 -11.429 27.419 1.00 0.00 H new ATOM 102 N LEU A 7 11.921 -11.331 23.852 1.00 0.00 N ATOM 103 CA LEU A 7 11.350 -12.006 22.653 1.00 0.00 C ATOM 104 C LEU A 7 10.683 -10.982 21.732 1.00 0.00 C ATOM 105 O LEU A 7 10.147 -9.984 22.176 1.00 0.00 O ATOM 106 CB LEU A 7 10.325 -13.003 23.192 1.00 0.00 C ATOM 107 CG LEU A 7 9.418 -12.315 24.208 1.00 0.00 C ATOM 108 CD1 LEU A 7 8.449 -11.384 23.476 1.00 0.00 C ATOM 109 CD2 LEU A 7 8.627 -13.377 24.976 1.00 0.00 C ATOM 0 H LEU A 7 11.322 -10.628 24.285 1.00 0.00 H new ATOM 0 HA LEU A 7 12.118 -12.505 22.063 1.00 0.00 H new ATOM 0 HB2 LEU A 7 9.729 -13.405 22.372 1.00 0.00 H new ATOM 0 HB3 LEU A 7 10.835 -13.846 23.658 1.00 0.00 H new ATOM 0 HG LEU A 7 10.021 -11.733 24.905 1.00 0.00 H new ATOM 0 HD11 LEU A 7 7.800 -10.892 24.200 1.00 0.00 H new ATOM 0 HD12 LEU A 7 9.013 -10.632 22.924 1.00 0.00 H new ATOM 0 HD13 LEU A 7 7.842 -11.964 22.781 1.00 0.00 H new ATOM 0 HD21 LEU A 7 7.977 -12.891 25.704 1.00 0.00 H new ATOM 0 HD22 LEU A 7 8.022 -13.955 24.278 1.00 0.00 H new ATOM 0 HD23 LEU A 7 9.318 -14.042 25.494 1.00 0.00 H new ATOM 121 N VAL A 8 10.718 -11.218 20.449 1.00 0.00 N ATOM 122 CA VAL A 8 10.095 -10.260 19.492 1.00 0.00 C ATOM 123 C VAL A 8 8.574 -10.435 19.477 1.00 0.00 C ATOM 124 O VAL A 8 8.067 -11.537 19.534 1.00 0.00 O ATOM 125 CB VAL A 8 10.689 -10.620 18.131 1.00 0.00 C ATOM 126 CG1 VAL A 8 12.215 -10.689 18.238 1.00 0.00 C ATOM 127 CG2 VAL A 8 10.150 -11.981 17.683 1.00 0.00 C ATOM 0 H VAL A 8 11.153 -12.036 20.021 1.00 0.00 H new ATOM 0 HA VAL A 8 10.290 -9.222 19.762 1.00 0.00 H new ATOM 0 HB VAL A 8 10.410 -9.858 17.403 1.00 0.00 H new ATOM 0 HG11 VAL A 8 12.637 -10.946 17.266 1.00 0.00 H new ATOM 0 HG12 VAL A 8 12.602 -9.721 18.557 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.495 -11.449 18.967 1.00 0.00 H new ATOM 0 HG21 VAL A 8 10.573 -12.238 16.712 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.428 -12.741 18.413 1.00 0.00 H new ATOM 0 HG23 VAL A 8 9.064 -11.934 17.604 1.00 0.00 H new ATOM 137 N VAL A 9 7.845 -9.356 19.402 1.00 0.00 N ATOM 138 CA VAL A 9 6.357 -9.460 19.384 1.00 0.00 C ATOM 139 C VAL A 9 5.771 -8.517 18.329 1.00 0.00 C ATOM 140 O VAL A 9 5.777 -7.312 18.487 1.00 0.00 O ATOM 141 CB VAL A 9 5.915 -9.033 20.783 1.00 0.00 C ATOM 142 CG1 VAL A 9 4.425 -9.327 20.960 1.00 0.00 C ATOM 143 CG2 VAL A 9 6.717 -9.808 21.830 1.00 0.00 C ATOM 0 H VAL A 9 8.214 -8.407 19.352 1.00 0.00 H new ATOM 0 HA VAL A 9 6.018 -10.466 19.135 1.00 0.00 H new ATOM 0 HB VAL A 9 6.091 -7.965 20.909 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.110 -9.022 21.958 1.00 0.00 H new ATOM 0 HG12 VAL A 9 3.854 -8.774 20.215 1.00 0.00 H new ATOM 0 HG13 VAL A 9 4.247 -10.395 20.834 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.402 -9.504 22.828 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.542 -10.877 21.704 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.779 -9.597 21.705 1.00 0.00 H new ATOM 153 N SER A 10 5.262 -9.057 17.256 1.00 0.00 N ATOM 154 CA SER A 10 4.670 -8.191 16.197 1.00 0.00 C ATOM 155 C SER A 10 3.188 -7.953 16.491 1.00 0.00 C ATOM 156 O SER A 10 2.364 -8.830 16.327 1.00 0.00 O ATOM 157 CB SER A 10 4.840 -8.978 14.898 1.00 0.00 C ATOM 158 OG SER A 10 5.032 -8.070 13.822 1.00 0.00 O ATOM 0 H SER A 10 5.230 -10.059 17.067 1.00 0.00 H new ATOM 0 HA SER A 10 5.149 -7.213 16.142 1.00 0.00 H new ATOM 0 HB2 SER A 10 5.693 -9.652 14.977 1.00 0.00 H new ATOM 0 HB3 SER A 10 3.961 -9.596 14.716 1.00 0.00 H new ATOM 0 HG SER A 10 5.143 -8.571 12.987 1.00 0.00 H new ATOM 164 N LEU A 11 2.840 -6.775 16.931 1.00 0.00 N ATOM 165 CA LEU A 11 1.411 -6.493 17.241 1.00 0.00 C ATOM 166 C LEU A 11 0.981 -5.159 16.625 1.00 0.00 C ATOM 167 O LEU A 11 1.679 -4.169 16.709 1.00 0.00 O ATOM 168 CB LEU A 11 1.345 -6.428 18.768 1.00 0.00 C ATOM 169 CG LEU A 11 2.309 -5.355 19.280 1.00 0.00 C ATOM 170 CD1 LEU A 11 1.630 -4.544 20.384 1.00 0.00 C ATOM 171 CD2 LEU A 11 3.564 -6.026 19.840 1.00 0.00 C ATOM 0 H LEU A 11 3.482 -5.998 17.089 1.00 0.00 H new ATOM 0 HA LEU A 11 0.744 -7.253 16.834 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.328 -6.200 19.088 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.604 -7.397 19.195 1.00 0.00 H new ATOM 0 HG LEU A 11 2.585 -4.692 18.460 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.316 -3.780 20.749 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.734 -4.067 19.987 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.355 -5.206 21.205 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.252 -5.264 20.205 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.287 -6.688 20.660 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.048 -6.605 19.054 1.00 0.00 H new ATOM 183 N ALA A 12 -0.169 -5.125 16.009 1.00 0.00 N ATOM 184 CA ALA A 12 -0.648 -3.854 15.395 1.00 0.00 C ATOM 185 C ALA A 12 -1.339 -2.996 16.456 1.00 0.00 C ATOM 186 O ALA A 12 -1.629 -3.454 17.544 1.00 0.00 O ATOM 187 CB ALA A 12 -1.642 -4.283 14.317 1.00 0.00 C ATOM 0 H ALA A 12 -0.797 -5.922 15.904 1.00 0.00 H new ATOM 0 HA ALA A 12 0.165 -3.258 14.979 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.040 -3.400 13.817 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -1.137 -4.916 13.587 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.459 -4.840 14.776 1.00 0.00 H new ATOM 193 N TYR A 13 -1.608 -1.755 16.156 1.00 0.00 N ATOM 194 CA TYR A 13 -2.280 -0.882 17.159 1.00 0.00 C ATOM 195 C TYR A 13 -3.007 0.274 16.467 1.00 0.00 C ATOM 196 O TYR A 13 -2.551 0.803 15.474 1.00 0.00 O ATOM 197 CB TYR A 13 -1.149 -0.351 18.042 1.00 0.00 C ATOM 198 CG TYR A 13 -0.018 0.139 17.171 1.00 0.00 C ATOM 199 CD1 TYR A 13 0.001 1.467 16.729 1.00 0.00 C ATOM 200 CD2 TYR A 13 1.014 -0.734 16.806 1.00 0.00 C ATOM 201 CE1 TYR A 13 1.051 1.922 15.922 1.00 0.00 C ATOM 202 CE2 TYR A 13 2.064 -0.280 15.999 1.00 0.00 C ATOM 203 CZ TYR A 13 2.082 1.048 15.557 1.00 0.00 C ATOM 204 OH TYR A 13 3.116 1.497 14.761 1.00 0.00 O ATOM 0 H TYR A 13 -1.393 -1.310 15.264 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.031 -1.424 17.734 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -1.515 0.460 18.671 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.794 -1.137 18.709 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -0.795 2.141 17.011 1.00 0.00 H new ATOM 0 HD2 TYR A 13 1.000 -1.759 17.147 1.00 0.00 H new ATOM 0 HE1 TYR A 13 1.066 2.947 15.581 1.00 0.00 H new ATOM 0 HE2 TYR A 13 2.860 -0.954 15.718 1.00 0.00 H new ATOM 0 HH TYR A 13 3.748 0.765 14.602 1.00 0.00 H new ATOM 214 N GLN A 14 -4.135 0.670 16.990 1.00 0.00 N ATOM 215 CA GLN A 14 -4.894 1.793 16.370 1.00 0.00 C ATOM 216 C GLN A 14 -5.060 2.931 17.382 1.00 0.00 C ATOM 217 O GLN A 14 -5.532 2.730 18.483 1.00 0.00 O ATOM 218 CB GLN A 14 -6.255 1.198 16.003 1.00 0.00 C ATOM 219 CG GLN A 14 -6.056 0.026 15.040 1.00 0.00 C ATOM 220 CD GLN A 14 -6.930 -1.150 15.482 1.00 0.00 C ATOM 221 OE1 GLN A 14 -6.502 -2.287 15.444 1.00 0.00 O ATOM 222 NE2 GLN A 14 -8.144 -0.925 15.902 1.00 0.00 N ATOM 0 H GLN A 14 -4.564 0.264 17.821 1.00 0.00 H new ATOM 0 HA GLN A 14 -4.386 2.208 15.500 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -6.771 0.860 16.902 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -6.884 1.959 15.541 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -6.318 0.326 14.025 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -5.008 -0.272 15.024 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -8.504 0.029 15.934 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -8.734 -1.703 16.198 1.00 0.00 H new ATOM 231 N VAL A 15 -4.671 4.122 17.020 1.00 0.00 N ATOM 232 CA VAL A 15 -4.802 5.266 17.967 1.00 0.00 C ATOM 233 C VAL A 15 -5.863 6.252 17.471 1.00 0.00 C ATOM 234 O VAL A 15 -5.839 6.689 16.337 1.00 0.00 O ATOM 235 CB VAL A 15 -3.423 5.924 17.984 1.00 0.00 C ATOM 236 CG1 VAL A 15 -2.977 6.214 16.550 1.00 0.00 C ATOM 237 CG2 VAL A 15 -3.494 7.235 18.770 1.00 0.00 C ATOM 0 H VAL A 15 -4.269 4.353 16.112 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.114 4.944 18.961 1.00 0.00 H new ATOM 0 HB VAL A 15 -2.707 5.253 18.458 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.993 6.683 16.563 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -2.927 5.281 15.989 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.693 6.885 16.075 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -2.511 7.705 18.783 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.211 7.905 18.296 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -3.811 7.030 19.792 1.00 0.00 H new ATOM 247 N ARG A 16 -6.792 6.608 18.314 1.00 0.00 N ATOM 248 CA ARG A 16 -7.854 7.568 17.897 1.00 0.00 C ATOM 249 C ARG A 16 -8.020 8.660 18.958 1.00 0.00 C ATOM 250 O ARG A 16 -8.049 8.388 20.142 1.00 0.00 O ATOM 251 CB ARG A 16 -9.127 6.728 17.785 1.00 0.00 C ATOM 252 CG ARG A 16 -10.347 7.651 17.746 1.00 0.00 C ATOM 253 CD ARG A 16 -11.625 6.809 17.744 1.00 0.00 C ATOM 254 NE ARG A 16 -11.851 6.452 19.172 1.00 0.00 N ATOM 255 CZ ARG A 16 -12.984 6.750 19.748 1.00 0.00 C ATOM 256 NH1 ARG A 16 -14.076 6.832 19.037 1.00 0.00 N ATOM 257 NH2 ARG A 16 -13.025 6.966 21.034 1.00 0.00 N ATOM 0 H ARG A 16 -6.862 6.275 19.276 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.616 8.069 16.959 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -9.093 6.115 16.884 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.201 6.046 18.632 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -10.340 8.318 18.608 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.312 8.280 16.857 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -12.467 7.370 17.339 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -11.510 5.918 17.127 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.121 5.975 19.700 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -14.044 6.663 18.032 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -14.961 7.065 19.487 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -12.172 6.902 21.589 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -13.910 7.199 21.484 1.00 0.00 H new ATOM 271 N THR A 17 -8.128 9.893 18.545 1.00 0.00 N ATOM 272 CA THR A 17 -8.288 10.997 19.534 1.00 0.00 C ATOM 273 C THR A 17 -9.770 11.204 19.863 1.00 0.00 C ATOM 274 O THR A 17 -10.639 10.931 19.059 1.00 0.00 O ATOM 275 CB THR A 17 -7.711 12.234 18.843 1.00 0.00 C ATOM 276 OG1 THR A 17 -8.281 12.364 17.549 1.00 0.00 O ATOM 277 CG2 THR A 17 -6.194 12.089 18.722 1.00 0.00 C ATOM 0 H THR A 17 -8.112 10.184 17.567 1.00 0.00 H new ATOM 0 HA THR A 17 -7.783 10.784 20.476 1.00 0.00 H new ATOM 0 HB THR A 17 -7.945 13.121 19.432 1.00 0.00 H new ATOM 0 HG1 THR A 17 -9.095 12.907 17.603 1.00 0.00 H new ATOM 0 HG21 THR A 17 -5.782 12.970 18.230 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.757 11.991 19.716 1.00 0.00 H new ATOM 0 HG23 THR A 17 -5.959 11.202 18.134 1.00 0.00 H new ATOM 285 N GLU A 18 -10.059 11.684 21.043 1.00 0.00 N ATOM 286 CA GLU A 18 -11.482 11.908 21.434 1.00 0.00 C ATOM 287 C GLU A 18 -12.177 12.830 20.427 1.00 0.00 C ATOM 288 O GLU A 18 -13.387 12.937 20.404 1.00 0.00 O ATOM 289 CB GLU A 18 -11.413 12.572 22.809 1.00 0.00 C ATOM 290 CG GLU A 18 -11.664 11.525 23.896 1.00 0.00 C ATOM 291 CD GLU A 18 -10.326 10.955 24.373 1.00 0.00 C ATOM 292 OE1 GLU A 18 -9.378 11.719 24.467 1.00 0.00 O ATOM 293 OE2 GLU A 18 -10.272 9.765 24.637 1.00 0.00 O ATOM 0 H GLU A 18 -9.371 11.931 21.754 1.00 0.00 H new ATOM 0 HA GLU A 18 -12.053 10.980 21.455 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.436 13.034 22.953 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.155 13.368 22.878 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.199 11.975 24.733 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.294 10.725 23.507 1.00 0.00 H new ATOM 300 N ASP A 19 -11.424 13.497 19.597 1.00 0.00 N ATOM 301 CA ASP A 19 -12.048 14.409 18.595 1.00 0.00 C ATOM 302 C ASP A 19 -12.572 13.607 17.399 1.00 0.00 C ATOM 303 O ASP A 19 -12.893 14.156 16.365 1.00 0.00 O ATOM 304 CB ASP A 19 -10.922 15.347 18.158 1.00 0.00 C ATOM 305 CG ASP A 19 -10.855 16.543 19.110 1.00 0.00 C ATOM 306 OD1 ASP A 19 -11.335 16.414 20.225 1.00 0.00 O ATOM 307 OD2 ASP A 19 -10.328 17.566 18.708 1.00 0.00 O ATOM 0 H ASP A 19 -10.405 13.451 19.568 1.00 0.00 H new ATOM 0 HA ASP A 19 -12.897 14.954 19.007 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -9.971 14.815 18.158 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -11.095 15.690 17.138 1.00 0.00 H new ATOM 312 N GLY A 20 -12.660 12.310 17.532 1.00 0.00 N ATOM 313 CA GLY A 20 -13.162 11.480 16.402 1.00 0.00 C ATOM 314 C GLY A 20 -12.121 11.464 15.284 1.00 0.00 C ATOM 315 O GLY A 20 -12.446 11.325 14.121 1.00 0.00 O ATOM 0 H GLY A 20 -12.406 11.792 18.373 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -13.362 10.464 16.743 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -14.104 11.883 16.031 1.00 0.00 H new ATOM 319 N VAL A 21 -10.870 11.607 15.625 1.00 0.00 N ATOM 320 CA VAL A 21 -9.807 11.602 14.579 1.00 0.00 C ATOM 321 C VAL A 21 -8.803 10.479 14.849 1.00 0.00 C ATOM 322 O VAL A 21 -8.582 10.088 15.978 1.00 0.00 O ATOM 323 CB VAL A 21 -9.129 12.968 14.696 1.00 0.00 C ATOM 324 CG1 VAL A 21 -8.304 13.238 13.437 1.00 0.00 C ATOM 325 CG2 VAL A 21 -10.196 14.055 14.847 1.00 0.00 C ATOM 0 H VAL A 21 -10.537 11.727 16.582 1.00 0.00 H new ATOM 0 HA VAL A 21 -10.211 11.432 13.581 1.00 0.00 H new ATOM 0 HB VAL A 21 -8.475 12.975 15.568 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -7.821 14.212 13.520 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.544 12.464 13.327 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -8.958 13.231 12.565 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -9.714 15.029 14.930 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -10.849 14.047 13.975 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -10.786 13.864 15.744 1.00 0.00 H new ATOM 335 N LEU A 22 -8.191 9.959 13.820 1.00 0.00 N ATOM 336 CA LEU A 22 -7.201 8.863 14.019 1.00 0.00 C ATOM 337 C LEU A 22 -5.787 9.366 13.714 1.00 0.00 C ATOM 338 O LEU A 22 -5.507 9.840 12.630 1.00 0.00 O ATOM 339 CB LEU A 22 -7.609 7.775 13.025 1.00 0.00 C ATOM 340 CG LEU A 22 -7.432 8.294 11.598 1.00 0.00 C ATOM 341 CD1 LEU A 22 -6.171 7.684 10.983 1.00 0.00 C ATOM 342 CD2 LEU A 22 -8.649 7.899 10.758 1.00 0.00 C ATOM 0 H LEU A 22 -8.334 10.245 12.851 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.193 8.495 15.045 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.001 6.883 13.177 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -8.647 7.486 13.192 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.338 9.380 11.617 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.046 8.055 9.966 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -5.303 7.964 11.580 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -6.264 6.598 10.964 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -8.524 8.269 9.740 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.742 6.813 10.741 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -9.549 8.334 11.194 1.00 0.00 H new ATOM 354 N VAL A 23 -4.895 9.266 14.660 1.00 0.00 N ATOM 355 CA VAL A 23 -3.501 9.739 14.421 1.00 0.00 C ATOM 356 C VAL A 23 -2.722 8.701 13.609 1.00 0.00 C ATOM 357 O VAL A 23 -1.800 9.027 12.888 1.00 0.00 O ATOM 358 CB VAL A 23 -2.892 9.898 15.815 1.00 0.00 C ATOM 359 CG1 VAL A 23 -1.426 10.316 15.688 1.00 0.00 C ATOM 360 CG2 VAL A 23 -3.662 10.971 16.588 1.00 0.00 C ATOM 0 H VAL A 23 -5.070 8.878 15.587 1.00 0.00 H new ATOM 0 HA VAL A 23 -3.472 10.670 13.855 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.954 8.949 16.348 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.993 10.429 16.682 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.876 9.553 15.137 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -1.363 11.264 15.155 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.229 11.085 17.582 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.600 11.919 16.054 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.707 10.674 16.680 1.00 0.00 H new ATOM 370 N ASP A 24 -3.087 7.452 13.720 1.00 0.00 N ATOM 371 CA ASP A 24 -2.367 6.394 12.953 1.00 0.00 C ATOM 372 C ASP A 24 -2.893 5.008 13.339 1.00 0.00 C ATOM 373 O ASP A 24 -3.355 4.795 14.442 1.00 0.00 O ATOM 374 CB ASP A 24 -0.900 6.542 13.355 1.00 0.00 C ATOM 375 CG ASP A 24 -0.127 5.288 12.940 1.00 0.00 C ATOM 376 OD1 ASP A 24 0.347 5.253 11.817 1.00 0.00 O ATOM 377 OD2 ASP A 24 -0.024 4.384 13.753 1.00 0.00 O ATOM 0 H ASP A 24 -3.851 7.119 14.308 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.507 6.497 11.877 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.469 7.422 12.878 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.820 6.691 14.432 1.00 0.00 H new ATOM 382 N GLU A 25 -2.828 4.067 12.439 1.00 0.00 N ATOM 383 CA GLU A 25 -3.323 2.696 12.756 1.00 0.00 C ATOM 384 C GLU A 25 -2.519 1.648 11.981 1.00 0.00 C ATOM 385 O GLU A 25 -2.108 1.871 10.860 1.00 0.00 O ATOM 386 CB GLU A 25 -4.785 2.691 12.306 1.00 0.00 C ATOM 387 CG GLU A 25 -4.851 2.655 10.777 1.00 0.00 C ATOM 388 CD GLU A 25 -4.337 3.982 10.213 1.00 0.00 C ATOM 389 OE1 GLU A 25 -4.986 4.990 10.440 1.00 0.00 O ATOM 390 OE2 GLU A 25 -3.303 3.966 9.565 1.00 0.00 O ATOM 0 H GLU A 25 -2.454 4.187 11.498 1.00 0.00 H new ATOM 0 HA GLU A 25 -3.220 2.454 13.814 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -5.301 1.826 12.723 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -5.295 3.578 12.681 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -4.251 1.829 10.396 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -5.876 2.482 10.451 1.00 0.00 H new ATOM 397 N SER A 26 -2.291 0.505 12.570 1.00 0.00 N ATOM 398 CA SER A 26 -1.514 -0.555 11.865 1.00 0.00 C ATOM 399 C SER A 26 -2.339 -1.842 11.772 1.00 0.00 C ATOM 400 O SER A 26 -2.614 -2.476 12.772 1.00 0.00 O ATOM 401 CB SER A 26 -0.272 -0.776 12.727 1.00 0.00 C ATOM 402 OG SER A 26 0.737 0.149 12.342 1.00 0.00 O ATOM 0 H SER A 26 -2.609 0.260 13.508 1.00 0.00 H new ATOM 0 HA SER A 26 -1.256 -0.269 10.845 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.518 -0.645 13.781 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.090 -1.797 12.609 1.00 0.00 H new ATOM 0 HG SER A 26 1.185 0.496 13.142 1.00 0.00 H new ATOM 408 N PRO A 27 -2.707 -2.184 10.567 1.00 0.00 N ATOM 409 CA PRO A 27 -3.510 -3.409 10.334 1.00 0.00 C ATOM 410 C PRO A 27 -2.642 -4.659 10.501 1.00 0.00 C ATOM 411 O PRO A 27 -1.447 -4.574 10.703 1.00 0.00 O ATOM 412 CB PRO A 27 -3.976 -3.260 8.888 1.00 0.00 C ATOM 413 CG PRO A 27 -2.964 -2.367 8.244 1.00 0.00 C ATOM 414 CD PRO A 27 -2.412 -1.468 9.322 1.00 0.00 C ATOM 0 HA PRO A 27 -4.337 -3.519 11.035 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.024 -4.227 8.387 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -4.974 -2.825 8.838 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.167 -2.955 7.788 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -3.421 -1.778 7.449 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.341 -1.307 9.198 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.886 -0.486 9.304 1.00 0.00 H new ATOM 422 N VAL A 28 -3.234 -5.819 10.420 1.00 0.00 N ATOM 423 CA VAL A 28 -2.442 -7.073 10.573 1.00 0.00 C ATOM 424 C VAL A 28 -1.561 -7.296 9.340 1.00 0.00 C ATOM 425 O VAL A 28 -0.688 -8.141 9.335 1.00 0.00 O ATOM 426 CB VAL A 28 -3.483 -8.185 10.697 1.00 0.00 C ATOM 427 CG1 VAL A 28 -2.786 -9.500 11.055 1.00 0.00 C ATOM 428 CG2 VAL A 28 -4.485 -7.825 11.796 1.00 0.00 C ATOM 0 H VAL A 28 -4.232 -5.953 10.255 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.777 -7.039 11.436 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.008 -8.298 9.748 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -3.529 -10.293 11.143 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.071 -9.758 10.273 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.261 -9.387 12.004 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -5.228 -8.618 11.885 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -3.960 -7.712 12.744 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.982 -6.889 11.543 1.00 0.00 H new ATOM 438 N SER A 29 -1.783 -6.543 8.298 1.00 0.00 N ATOM 439 CA SER A 29 -0.958 -6.712 7.067 1.00 0.00 C ATOM 440 C SER A 29 0.408 -6.044 7.251 1.00 0.00 C ATOM 441 O SER A 29 1.302 -6.205 6.444 1.00 0.00 O ATOM 442 CB SER A 29 -1.750 -6.018 5.961 1.00 0.00 C ATOM 443 OG SER A 29 -1.585 -4.610 6.079 1.00 0.00 O ATOM 0 H SER A 29 -2.499 -5.819 8.245 1.00 0.00 H new ATOM 0 HA SER A 29 -0.770 -7.761 6.836 1.00 0.00 H new ATOM 0 HB2 SER A 29 -1.405 -6.356 4.984 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.806 -6.280 6.034 1.00 0.00 H new ATOM 0 HG SER A 29 -2.091 -4.161 5.370 1.00 0.00 H new ATOM 449 N ALA A 30 0.575 -5.294 8.306 1.00 0.00 N ATOM 450 CA ALA A 30 1.882 -4.617 8.540 1.00 0.00 C ATOM 451 C ALA A 30 2.084 -4.356 10.035 1.00 0.00 C ATOM 452 O ALA A 30 2.215 -3.223 10.456 1.00 0.00 O ATOM 453 CB ALA A 30 1.786 -3.297 7.773 1.00 0.00 C ATOM 0 H ALA A 30 -0.137 -5.121 9.016 1.00 0.00 H new ATOM 0 HA ALA A 30 2.726 -5.222 8.208 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.713 -2.737 7.895 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.623 -3.502 6.715 1.00 0.00 H new ATOM 0 HB3 ALA A 30 0.954 -2.710 8.161 1.00 0.00 H new ATOM 459 N PRO A 31 2.105 -5.420 10.789 1.00 0.00 N ATOM 460 CA PRO A 31 2.293 -5.312 12.256 1.00 0.00 C ATOM 461 C PRO A 31 3.744 -4.944 12.582 1.00 0.00 C ATOM 462 O PRO A 31 4.671 -5.406 11.946 1.00 0.00 O ATOM 463 CB PRO A 31 1.959 -6.712 12.764 1.00 0.00 C ATOM 464 CG PRO A 31 2.208 -7.618 11.599 1.00 0.00 C ATOM 465 CD PRO A 31 1.954 -6.812 10.350 1.00 0.00 C ATOM 0 HA PRO A 31 1.674 -4.540 12.713 1.00 0.00 H new ATOM 0 HB2 PRO A 31 2.584 -6.983 13.615 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.923 -6.774 13.097 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.231 -7.993 11.614 1.00 0.00 H new ATOM 0 HG3 PRO A 31 1.550 -8.486 11.638 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.665 -7.062 9.562 1.00 0.00 H new ATOM 0 HD3 PRO A 31 0.957 -6.999 9.950 1.00 0.00 H new ATOM 473 N LEU A 32 3.948 -4.115 13.569 1.00 0.00 N ATOM 474 CA LEU A 32 5.337 -3.718 13.934 1.00 0.00 C ATOM 475 C LEU A 32 5.972 -4.781 14.835 1.00 0.00 C ATOM 476 O LEU A 32 5.512 -5.034 15.931 1.00 0.00 O ATOM 477 CB LEU A 32 5.187 -2.396 14.686 1.00 0.00 C ATOM 478 CG LEU A 32 6.568 -1.885 15.102 1.00 0.00 C ATOM 479 CD1 LEU A 32 7.344 -1.443 13.861 1.00 0.00 C ATOM 480 CD2 LEU A 32 6.406 -0.698 16.053 1.00 0.00 C ATOM 0 H LEU A 32 3.213 -3.696 14.138 1.00 0.00 H new ATOM 0 HA LEU A 32 5.981 -3.618 13.060 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.691 -1.660 14.053 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.559 -2.535 15.566 1.00 0.00 H new ATOM 0 HG LEU A 32 7.114 -2.682 15.606 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.328 -1.079 14.158 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.459 -2.289 13.183 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.799 -0.645 13.356 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.389 -0.333 16.350 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.860 0.100 15.550 1.00 0.00 H new ATOM 0 HD23 LEU A 32 5.853 -1.014 16.938 1.00 0.00 H new ATOM 492 N ASP A 33 7.026 -5.403 14.382 1.00 0.00 N ATOM 493 CA ASP A 33 7.690 -6.449 15.212 1.00 0.00 C ATOM 494 C ASP A 33 8.826 -5.831 16.030 1.00 0.00 C ATOM 495 O ASP A 33 9.885 -5.535 15.514 1.00 0.00 O ATOM 496 CB ASP A 33 8.241 -7.462 14.209 1.00 0.00 C ATOM 497 CG ASP A 33 9.176 -6.754 13.228 1.00 0.00 C ATOM 498 OD1 ASP A 33 8.743 -5.791 12.618 1.00 0.00 O ATOM 499 OD2 ASP A 33 10.310 -7.187 13.102 1.00 0.00 O ATOM 0 H ASP A 33 7.456 -5.232 13.473 1.00 0.00 H new ATOM 0 HA ASP A 33 7.003 -6.911 15.921 1.00 0.00 H new ATOM 0 HB2 ASP A 33 8.778 -8.253 14.733 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.422 -7.937 13.669 1.00 0.00 H new ATOM 504 N TYR A 34 8.617 -5.637 17.303 1.00 0.00 N ATOM 505 CA TYR A 34 9.690 -5.042 18.149 1.00 0.00 C ATOM 506 C TYR A 34 9.844 -5.841 19.447 1.00 0.00 C ATOM 507 O TYR A 34 9.013 -6.658 19.787 1.00 0.00 O ATOM 508 CB TYR A 34 9.223 -3.616 18.442 1.00 0.00 C ATOM 509 CG TYR A 34 7.938 -3.653 19.231 1.00 0.00 C ATOM 510 CD1 TYR A 34 7.946 -4.089 20.561 1.00 0.00 C ATOM 511 CD2 TYR A 34 6.738 -3.248 18.636 1.00 0.00 C ATOM 512 CE1 TYR A 34 6.754 -4.120 21.295 1.00 0.00 C ATOM 513 CE2 TYR A 34 5.546 -3.278 19.370 1.00 0.00 C ATOM 514 CZ TYR A 34 5.555 -3.715 20.699 1.00 0.00 C ATOM 515 OH TYR A 34 4.380 -3.745 21.423 1.00 0.00 O ATOM 0 H TYR A 34 7.752 -5.864 17.793 1.00 0.00 H new ATOM 0 HA TYR A 34 10.661 -5.055 17.654 1.00 0.00 H new ATOM 0 HB2 TYR A 34 9.989 -3.080 19.002 1.00 0.00 H new ATOM 0 HB3 TYR A 34 9.072 -3.074 17.509 1.00 0.00 H new ATOM 0 HD1 TYR A 34 8.872 -4.402 21.021 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.731 -2.912 17.610 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.760 -4.457 22.321 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.620 -2.964 18.911 1.00 0.00 H new ATOM 0 HH TYR A 34 4.568 -3.531 22.361 1.00 0.00 H new ATOM 525 N LEU A 35 10.907 -5.612 20.170 1.00 0.00 N ATOM 526 CA LEU A 35 11.121 -6.361 21.442 1.00 0.00 C ATOM 527 C LEU A 35 10.258 -5.772 22.563 1.00 0.00 C ATOM 528 O LEU A 35 10.105 -4.572 22.678 1.00 0.00 O ATOM 529 CB LEU A 35 12.606 -6.181 21.754 1.00 0.00 C ATOM 530 CG LEU A 35 13.144 -7.449 22.418 1.00 0.00 C ATOM 531 CD1 LEU A 35 12.983 -8.634 21.465 1.00 0.00 C ATOM 532 CD2 LEU A 35 14.627 -7.259 22.748 1.00 0.00 C ATOM 0 H LEU A 35 11.636 -4.939 19.935 1.00 0.00 H new ATOM 0 HA LEU A 35 10.844 -7.412 21.355 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.159 -5.975 20.838 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.749 -5.324 22.412 1.00 0.00 H new ATOM 0 HG LEU A 35 12.587 -7.643 23.335 1.00 0.00 H new ATOM 0 HD11 LEU A 35 13.367 -9.537 21.939 1.00 0.00 H new ATOM 0 HD12 LEU A 35 11.928 -8.769 21.228 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.539 -8.441 20.548 1.00 0.00 H new ATOM 0 HD21 LEU A 35 15.013 -8.162 23.222 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.182 -7.065 21.830 1.00 0.00 H new ATOM 0 HD23 LEU A 35 14.743 -6.415 23.428 1.00 0.00 H new ATOM 544 N HIS A 36 9.692 -6.610 23.388 1.00 0.00 N ATOM 545 CA HIS A 36 8.836 -6.105 24.502 1.00 0.00 C ATOM 546 C HIS A 36 9.699 -5.706 25.702 1.00 0.00 C ATOM 547 O HIS A 36 10.748 -6.272 25.941 1.00 0.00 O ATOM 548 CB HIS A 36 7.928 -7.280 24.863 1.00 0.00 C ATOM 549 CG HIS A 36 6.997 -6.873 25.972 1.00 0.00 C ATOM 550 ND1 HIS A 36 7.179 -7.290 27.282 1.00 0.00 N ATOM 551 CD2 HIS A 36 5.872 -6.085 25.982 1.00 0.00 C ATOM 552 CE1 HIS A 36 6.186 -6.757 28.018 1.00 0.00 C ATOM 553 NE2 HIS A 36 5.362 -6.014 27.276 1.00 0.00 N ATOM 0 H HIS A 36 9.785 -7.625 23.340 1.00 0.00 H new ATOM 0 HA HIS A 36 8.268 -5.220 24.216 1.00 0.00 H new ATOM 0 HB2 HIS A 36 7.356 -7.593 23.990 1.00 0.00 H new ATOM 0 HB3 HIS A 36 8.528 -8.135 25.173 1.00 0.00 H new ATOM 0 HD2 HIS A 36 5.448 -5.595 25.118 1.00 0.00 H new ATOM 0 HE1 HIS A 36 6.070 -6.912 29.081 1.00 0.00 H new ATOM 0 HE2 HIS A 36 4.536 -5.504 27.589 1.00 0.00 H new ATOM 561 N GLY A 37 9.267 -4.734 26.459 1.00 0.00 N ATOM 562 CA GLY A 37 10.061 -4.299 27.644 1.00 0.00 C ATOM 563 C GLY A 37 11.070 -3.233 27.217 1.00 0.00 C ATOM 564 O GLY A 37 11.168 -2.181 27.815 1.00 0.00 O ATOM 0 H GLY A 37 8.398 -4.222 26.308 1.00 0.00 H new ATOM 0 HA2 GLY A 37 9.399 -3.901 28.413 1.00 0.00 H new ATOM 0 HA3 GLY A 37 10.580 -5.152 28.081 1.00 0.00 H new ATOM 568 N HIS A 38 11.816 -3.496 26.181 1.00 0.00 N ATOM 569 CA HIS A 38 12.817 -2.497 25.706 1.00 0.00 C ATOM 570 C HIS A 38 12.662 -2.275 24.199 1.00 0.00 C ATOM 571 O HIS A 38 13.308 -2.918 23.397 1.00 0.00 O ATOM 572 CB HIS A 38 14.191 -3.097 26.026 1.00 0.00 C ATOM 573 CG HIS A 38 14.161 -4.592 25.846 1.00 0.00 C ATOM 574 ND1 HIS A 38 14.905 -5.445 26.645 1.00 0.00 N ATOM 575 CD2 HIS A 38 13.488 -5.398 24.963 1.00 0.00 C ATOM 576 CE1 HIS A 38 14.664 -6.702 26.231 1.00 0.00 C ATOM 577 NE2 HIS A 38 13.807 -6.731 25.208 1.00 0.00 N ATOM 0 H HIS A 38 11.777 -4.360 25.641 1.00 0.00 H new ATOM 0 HA HIS A 38 12.686 -1.529 26.189 1.00 0.00 H new ATOM 0 HB2 HIS A 38 14.947 -2.660 25.374 1.00 0.00 H new ATOM 0 HB3 HIS A 38 14.473 -2.852 27.050 1.00 0.00 H new ATOM 0 HD1 HIS A 38 15.523 -5.170 27.408 1.00 0.00 H new ATOM 0 HD2 HIS A 38 12.813 -5.051 24.194 1.00 0.00 H new ATOM 0 HE1 HIS A 38 15.110 -7.581 26.673 1.00 0.00 H new ATOM 585 N GLY A 39 11.804 -1.370 23.812 1.00 0.00 N ATOM 586 CA GLY A 39 11.601 -1.107 22.360 1.00 0.00 C ATOM 587 C GLY A 39 10.153 -1.430 21.983 1.00 0.00 C ATOM 588 O GLY A 39 9.891 -2.313 21.190 1.00 0.00 O ATOM 0 H GLY A 39 11.235 -0.802 24.440 1.00 0.00 H new ATOM 0 HA2 GLY A 39 11.824 -0.064 22.133 1.00 0.00 H new ATOM 0 HA3 GLY A 39 12.287 -1.715 21.770 1.00 0.00 H new ATOM 592 N SER A 40 9.211 -0.725 22.549 1.00 0.00 N ATOM 593 CA SER A 40 7.781 -0.995 22.225 1.00 0.00 C ATOM 594 C SER A 40 6.980 0.310 22.230 1.00 0.00 C ATOM 595 O SER A 40 5.972 0.428 22.900 1.00 0.00 O ATOM 596 CB SER A 40 7.293 -1.926 23.334 1.00 0.00 C ATOM 597 OG SER A 40 5.971 -2.357 23.038 1.00 0.00 O ATOM 0 H SER A 40 9.370 0.026 23.221 1.00 0.00 H new ATOM 0 HA SER A 40 7.659 -1.438 21.237 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.957 -2.786 23.421 1.00 0.00 H new ATOM 0 HB3 SER A 40 7.313 -1.409 24.293 1.00 0.00 H new ATOM 0 HG SER A 40 5.858 -2.422 22.067 1.00 0.00 H new ATOM 603 N LEU A 41 7.418 1.289 21.487 1.00 0.00 N ATOM 604 CA LEU A 41 6.681 2.586 21.445 1.00 0.00 C ATOM 605 C LEU A 41 6.768 3.291 22.802 1.00 0.00 C ATOM 606 O LEU A 41 7.425 4.302 22.946 1.00 0.00 O ATOM 607 CB LEU A 41 5.231 2.214 21.125 1.00 0.00 C ATOM 608 CG LEU A 41 5.204 1.110 20.066 1.00 0.00 C ATOM 609 CD1 LEU A 41 4.685 -0.186 20.690 1.00 0.00 C ATOM 610 CD2 LEU A 41 4.282 1.529 18.920 1.00 0.00 C ATOM 0 H LEU A 41 8.255 1.248 20.906 1.00 0.00 H new ATOM 0 HA LEU A 41 7.097 3.270 20.705 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.724 1.877 22.029 1.00 0.00 H new ATOM 0 HB3 LEU A 41 4.692 3.090 20.765 1.00 0.00 H new ATOM 0 HG LEU A 41 6.212 0.949 19.684 1.00 0.00 H new ATOM 0 HD11 LEU A 41 4.666 -0.972 19.935 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.341 -0.484 21.508 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.677 -0.027 21.073 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.261 0.744 18.164 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.275 1.690 19.304 1.00 0.00 H new ATOM 0 HD23 LEU A 41 4.652 2.452 18.474 1.00 0.00 H new ATOM 622 N ILE A 42 6.108 2.766 23.800 1.00 0.00 N ATOM 623 CA ILE A 42 6.153 3.410 25.144 1.00 0.00 C ATOM 624 C ILE A 42 5.962 2.360 26.242 1.00 0.00 C ATOM 625 O ILE A 42 5.501 1.264 25.992 1.00 0.00 O ATOM 626 CB ILE A 42 4.992 4.404 25.146 1.00 0.00 C ATOM 627 CG1 ILE A 42 3.712 3.692 24.705 1.00 0.00 C ATOM 628 CG2 ILE A 42 5.297 5.548 24.176 1.00 0.00 C ATOM 629 CD1 ILE A 42 2.617 4.727 24.438 1.00 0.00 C ATOM 0 H ILE A 42 5.541 1.920 23.742 1.00 0.00 H new ATOM 0 HA ILE A 42 7.109 3.898 25.335 1.00 0.00 H new ATOM 0 HB ILE A 42 4.859 4.805 26.151 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.901 3.107 23.805 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.387 2.994 25.477 1.00 0.00 H new ATOM 0 HG21 ILE A 42 4.469 6.257 24.177 1.00 0.00 H new ATOM 0 HG22 ILE A 42 6.210 6.056 24.488 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.430 5.147 23.171 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.705 4.219 24.124 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.422 5.293 25.349 1.00 0.00 H new ATOM 0 HD13 ILE A 42 2.943 5.407 23.651 1.00 0.00 H new ATOM 641 N SER A 43 6.311 2.688 27.455 1.00 0.00 N ATOM 642 CA SER A 43 6.148 1.710 28.569 1.00 0.00 C ATOM 643 C SER A 43 4.675 1.611 28.974 1.00 0.00 C ATOM 644 O SER A 43 4.156 0.536 29.206 1.00 0.00 O ATOM 645 CB SER A 43 6.983 2.274 29.718 1.00 0.00 C ATOM 646 OG SER A 43 6.156 3.078 30.549 1.00 0.00 O ATOM 0 H SER A 43 6.702 3.591 27.724 1.00 0.00 H new ATOM 0 HA SER A 43 6.468 0.707 28.288 1.00 0.00 H new ATOM 0 HB2 SER A 43 7.420 1.461 30.298 1.00 0.00 H new ATOM 0 HB3 SER A 43 7.809 2.866 29.326 1.00 0.00 H new ATOM 0 HG SER A 43 6.688 3.440 31.288 1.00 0.00 H new ATOM 652 N GLY A 44 3.998 2.722 29.061 1.00 0.00 N ATOM 653 CA GLY A 44 2.559 2.690 29.450 1.00 0.00 C ATOM 654 C GLY A 44 1.844 1.586 28.671 1.00 0.00 C ATOM 655 O GLY A 44 1.054 0.841 29.216 1.00 0.00 O ATOM 0 H GLY A 44 4.378 3.651 28.880 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.465 2.513 30.521 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.094 3.654 29.244 1.00 0.00 H new ATOM 659 N LEU A 45 2.113 1.474 27.399 1.00 0.00 N ATOM 660 CA LEU A 45 1.448 0.417 26.586 1.00 0.00 C ATOM 661 C LEU A 45 2.128 -0.935 26.818 1.00 0.00 C ATOM 662 O LEU A 45 1.494 -1.971 26.797 1.00 0.00 O ATOM 663 CB LEU A 45 1.623 0.864 25.135 1.00 0.00 C ATOM 664 CG LEU A 45 0.521 0.246 24.272 1.00 0.00 C ATOM 665 CD1 LEU A 45 0.856 0.447 22.793 1.00 0.00 C ATOM 666 CD2 LEU A 45 0.419 -1.251 24.571 1.00 0.00 C ATOM 0 H LEU A 45 2.765 2.069 26.888 1.00 0.00 H new ATOM 0 HA LEU A 45 0.398 0.293 26.850 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.582 1.951 25.071 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.602 0.560 24.765 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.430 0.729 24.498 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.071 0.006 22.179 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.930 1.513 22.578 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.807 -0.035 22.567 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.366 -1.692 23.957 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.370 -1.733 24.345 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.180 -1.396 25.624 1.00 0.00 H new ATOM 678 N GLU A 46 3.414 -0.932 27.038 1.00 0.00 N ATOM 679 CA GLU A 46 4.134 -2.218 27.271 1.00 0.00 C ATOM 680 C GLU A 46 3.464 -3.001 28.403 1.00 0.00 C ATOM 681 O GLU A 46 3.165 -4.171 28.268 1.00 0.00 O ATOM 682 CB GLU A 46 5.553 -1.809 27.667 1.00 0.00 C ATOM 683 CG GLU A 46 6.363 -1.490 26.409 1.00 0.00 C ATOM 684 CD GLU A 46 7.634 -0.734 26.798 1.00 0.00 C ATOM 685 OE1 GLU A 46 7.976 -0.752 27.970 1.00 0.00 O ATOM 686 OE2 GLU A 46 8.245 -0.149 25.919 1.00 0.00 O ATOM 0 H GLU A 46 3.998 -0.096 27.067 1.00 0.00 H new ATOM 0 HA GLU A 46 4.126 -2.863 26.392 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.522 -0.939 28.323 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.032 -2.613 28.226 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.621 -2.411 25.886 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.766 -0.890 25.722 1.00 0.00 H new ATOM 693 N THR A 47 3.226 -2.365 29.517 1.00 0.00 N ATOM 694 CA THR A 47 2.574 -3.075 30.655 1.00 0.00 C ATOM 695 C THR A 47 1.337 -3.832 30.168 1.00 0.00 C ATOM 696 O THR A 47 0.977 -4.862 30.702 1.00 0.00 O ATOM 697 CB THR A 47 2.177 -1.971 31.636 1.00 0.00 C ATOM 698 OG1 THR A 47 1.600 -0.888 30.919 1.00 0.00 O ATOM 699 CG2 THR A 47 3.415 -1.485 32.390 1.00 0.00 C ATOM 0 H THR A 47 3.454 -1.386 29.689 1.00 0.00 H new ATOM 0 HA THR A 47 3.234 -3.810 31.115 1.00 0.00 H new ATOM 0 HB THR A 47 1.452 -2.362 32.350 1.00 0.00 H new ATOM 0 HG1 THR A 47 1.344 -0.180 31.546 1.00 0.00 H new ATOM 0 HG21 THR A 47 3.130 -0.698 33.089 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.856 -2.316 32.940 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.143 -1.093 31.680 1.00 0.00 H new ATOM 707 N ALA A 48 0.683 -3.330 29.155 1.00 0.00 N ATOM 708 CA ALA A 48 -0.530 -4.024 28.634 1.00 0.00 C ATOM 709 C ALA A 48 -0.125 -5.197 27.739 1.00 0.00 C ATOM 710 O ALA A 48 -0.872 -6.138 27.555 1.00 0.00 O ATOM 711 CB ALA A 48 -1.274 -2.962 27.823 1.00 0.00 C ATOM 0 H ALA A 48 0.936 -2.471 28.667 1.00 0.00 H new ATOM 0 HA ALA A 48 -1.147 -4.434 29.433 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.183 -3.395 27.404 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -1.536 -2.126 28.472 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -0.635 -2.607 27.015 1.00 0.00 H new ATOM 717 N LEU A 49 1.054 -5.150 27.181 1.00 0.00 N ATOM 718 CA LEU A 49 1.507 -6.264 26.297 1.00 0.00 C ATOM 719 C LEU A 49 1.987 -7.446 27.144 1.00 0.00 C ATOM 720 O LEU A 49 1.919 -8.586 26.730 1.00 0.00 O ATOM 721 CB LEU A 49 2.663 -5.681 25.486 1.00 0.00 C ATOM 722 CG LEU A 49 2.300 -5.686 23.999 1.00 0.00 C ATOM 723 CD1 LEU A 49 1.756 -7.062 23.611 1.00 0.00 C ATOM 724 CD2 LEU A 49 1.233 -4.623 23.732 1.00 0.00 C ATOM 0 H LEU A 49 1.723 -4.389 27.298 1.00 0.00 H new ATOM 0 HA LEU A 49 0.707 -6.635 25.656 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.875 -4.664 25.816 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.568 -6.265 25.652 1.00 0.00 H new ATOM 0 HG LEU A 49 3.189 -5.467 23.407 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.497 -7.066 22.552 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.515 -7.820 23.802 1.00 0.00 H new ATOM 0 HD13 LEU A 49 0.867 -7.282 24.202 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.974 -4.626 22.673 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.344 -4.843 24.324 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.620 -3.642 24.008 1.00 0.00 H new ATOM 736 N GLU A 50 2.473 -7.183 28.326 1.00 0.00 N ATOM 737 CA GLU A 50 2.957 -8.292 29.198 1.00 0.00 C ATOM 738 C GLU A 50 1.791 -9.202 29.592 1.00 0.00 C ATOM 739 O GLU A 50 0.706 -8.743 29.891 1.00 0.00 O ATOM 740 CB GLU A 50 3.539 -7.600 30.431 1.00 0.00 C ATOM 741 CG GLU A 50 3.729 -8.626 31.550 1.00 0.00 C ATOM 742 CD GLU A 50 4.455 -7.970 32.727 1.00 0.00 C ATOM 743 OE1 GLU A 50 5.672 -7.907 32.686 1.00 0.00 O ATOM 744 OE2 GLU A 50 3.780 -7.542 33.649 1.00 0.00 O ATOM 0 H GLU A 50 2.556 -6.248 28.726 1.00 0.00 H new ATOM 0 HA GLU A 50 3.694 -8.920 28.698 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.493 -7.135 30.184 1.00 0.00 H new ATOM 0 HB3 GLU A 50 2.873 -6.804 30.763 1.00 0.00 H new ATOM 0 HG2 GLU A 50 2.762 -9.010 31.874 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.303 -9.477 31.184 1.00 0.00 H new ATOM 751 N GLY A 51 2.006 -10.489 29.595 1.00 0.00 N ATOM 752 CA GLY A 51 0.910 -11.426 29.970 1.00 0.00 C ATOM 753 C GLY A 51 -0.279 -11.226 29.029 1.00 0.00 C ATOM 754 O GLY A 51 -1.351 -10.831 29.443 1.00 0.00 O ATOM 0 H GLY A 51 2.893 -10.932 29.354 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.263 -12.456 29.913 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.604 -11.250 31.001 1.00 0.00 H new ATOM 758 N HIS A 52 -0.100 -11.495 27.765 1.00 0.00 N ATOM 759 CA HIS A 52 -1.219 -11.319 26.798 1.00 0.00 C ATOM 760 C HIS A 52 -1.520 -12.648 26.095 1.00 0.00 C ATOM 761 O HIS A 52 -1.736 -13.660 26.732 1.00 0.00 O ATOM 762 CB HIS A 52 -0.716 -10.276 25.800 1.00 0.00 C ATOM 763 CG HIS A 52 -1.888 -9.618 25.125 1.00 0.00 C ATOM 764 ND1 HIS A 52 -3.193 -10.034 25.339 1.00 0.00 N ATOM 765 CD2 HIS A 52 -1.969 -8.573 24.239 1.00 0.00 C ATOM 766 CE1 HIS A 52 -3.996 -9.250 24.598 1.00 0.00 C ATOM 767 NE2 HIS A 52 -3.301 -8.342 23.907 1.00 0.00 N ATOM 0 H HIS A 52 0.774 -11.830 27.360 1.00 0.00 H new ATOM 0 HA HIS A 52 -2.143 -11.003 27.281 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -0.112 -9.528 26.314 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -0.074 -10.749 25.057 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -1.127 -8.015 23.857 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -5.071 -9.343 24.565 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -3.668 -7.632 23.273 1.00 0.00 H new ATOM 775 N GLU A 53 -1.537 -12.656 24.790 1.00 0.00 N ATOM 776 CA GLU A 53 -1.824 -13.923 24.057 1.00 0.00 C ATOM 777 C GLU A 53 -1.752 -13.690 22.546 1.00 0.00 C ATOM 778 O GLU A 53 -1.988 -12.600 22.065 1.00 0.00 O ATOM 779 CB GLU A 53 -3.242 -14.310 24.475 1.00 0.00 C ATOM 780 CG GLU A 53 -3.252 -15.757 24.972 1.00 0.00 C ATOM 781 CD GLU A 53 -4.588 -16.055 25.654 1.00 0.00 C ATOM 782 OE1 GLU A 53 -5.432 -15.173 25.670 1.00 0.00 O ATOM 783 OE2 GLU A 53 -4.747 -17.158 26.149 1.00 0.00 O ATOM 0 H GLU A 53 -1.365 -11.842 24.200 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.103 -14.707 24.290 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.596 -13.642 25.261 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -3.924 -14.199 23.632 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.098 -16.440 24.137 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.431 -15.918 25.671 1.00 0.00 H new ATOM 790 N VAL A 54 -1.429 -14.705 21.794 1.00 0.00 N ATOM 791 CA VAL A 54 -1.342 -14.542 20.315 1.00 0.00 C ATOM 792 C VAL A 54 -2.736 -14.471 19.706 1.00 0.00 C ATOM 793 O VAL A 54 -3.522 -15.391 19.804 1.00 0.00 O ATOM 794 CB VAL A 54 -0.599 -15.782 19.818 1.00 0.00 C ATOM 795 CG1 VAL A 54 -0.480 -15.731 18.294 1.00 0.00 C ATOM 796 CG2 VAL A 54 0.800 -15.819 20.437 1.00 0.00 C ATOM 0 H VAL A 54 -1.221 -15.642 22.140 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.829 -13.622 20.034 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.150 -16.676 20.109 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.050 -16.616 17.941 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -1.476 -15.704 17.852 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.071 -14.837 18.002 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.331 -16.703 20.083 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.350 -14.924 20.146 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.716 -15.856 21.523 1.00 0.00 H new ATOM 806 N GLY A 55 -3.040 -13.378 19.070 1.00 0.00 N ATOM 807 CA GLY A 55 -4.375 -13.234 18.444 1.00 0.00 C ATOM 808 C GLY A 55 -5.310 -12.477 19.388 1.00 0.00 C ATOM 809 O GLY A 55 -6.468 -12.260 19.090 1.00 0.00 O ATOM 0 H GLY A 55 -2.418 -12.577 18.958 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.288 -12.700 17.498 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.789 -14.217 18.218 1.00 0.00 H new ATOM 813 N ASP A 56 -4.818 -12.073 20.527 1.00 0.00 N ATOM 814 CA ASP A 56 -5.681 -11.330 21.492 1.00 0.00 C ATOM 815 C ASP A 56 -5.604 -9.826 21.218 1.00 0.00 C ATOM 816 O ASP A 56 -4.536 -9.248 21.169 1.00 0.00 O ATOM 817 CB ASP A 56 -5.104 -11.656 22.870 1.00 0.00 C ATOM 818 CG ASP A 56 -6.183 -11.454 23.935 1.00 0.00 C ATOM 819 OD1 ASP A 56 -7.343 -11.371 23.568 1.00 0.00 O ATOM 820 OD2 ASP A 56 -5.831 -11.389 25.102 1.00 0.00 O ATOM 0 H ASP A 56 -3.857 -12.225 20.832 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.731 -11.613 21.413 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.745 -12.685 22.892 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.248 -11.015 23.078 1.00 0.00 H new ATOM 825 N LYS A 57 -6.727 -9.188 21.036 1.00 0.00 N ATOM 826 CA LYS A 57 -6.716 -7.722 20.763 1.00 0.00 C ATOM 827 C LYS A 57 -7.396 -6.965 21.908 1.00 0.00 C ATOM 828 O LYS A 57 -8.422 -7.374 22.413 1.00 0.00 O ATOM 829 CB LYS A 57 -7.508 -7.554 19.466 1.00 0.00 C ATOM 830 CG LYS A 57 -7.027 -8.580 18.438 1.00 0.00 C ATOM 831 CD LYS A 57 -7.840 -8.435 17.150 1.00 0.00 C ATOM 832 CE LYS A 57 -9.324 -8.651 17.456 1.00 0.00 C ATOM 833 NZ LYS A 57 -9.954 -8.919 16.134 1.00 0.00 N ATOM 0 H LYS A 57 -7.652 -9.617 21.064 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.704 -7.326 20.677 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -8.573 -7.687 19.658 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.378 -6.544 19.076 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -5.967 -8.432 18.230 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -7.136 -9.588 18.837 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -7.687 -7.445 16.720 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.501 -9.160 16.410 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -9.469 -9.488 18.139 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.761 -7.773 17.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.974 -9.078 16.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -9.806 -8.103 15.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.523 -9.764 15.709 1.00 0.00 H new ATOM 847 N PHE A 58 -6.831 -5.862 22.319 1.00 0.00 N ATOM 848 CA PHE A 58 -7.444 -5.079 23.430 1.00 0.00 C ATOM 849 C PHE A 58 -7.313 -3.579 23.151 1.00 0.00 C ATOM 850 O PHE A 58 -6.720 -3.169 22.174 1.00 0.00 O ATOM 851 CB PHE A 58 -6.647 -5.466 24.676 1.00 0.00 C ATOM 852 CG PHE A 58 -5.250 -4.902 24.574 1.00 0.00 C ATOM 853 CD1 PHE A 58 -4.280 -5.568 23.816 1.00 0.00 C ATOM 854 CD2 PHE A 58 -4.924 -3.713 25.238 1.00 0.00 C ATOM 855 CE1 PHE A 58 -2.984 -5.045 23.722 1.00 0.00 C ATOM 856 CE2 PHE A 58 -3.629 -3.191 25.145 1.00 0.00 C ATOM 857 CZ PHE A 58 -2.659 -3.857 24.386 1.00 0.00 C ATOM 0 H PHE A 58 -5.972 -5.469 21.934 1.00 0.00 H new ATOM 0 HA PHE A 58 -8.507 -5.289 23.547 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -7.141 -5.084 25.570 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -6.607 -6.551 24.773 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.531 -6.485 23.304 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -5.673 -3.199 25.822 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -2.236 -5.559 23.137 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -3.378 -2.275 25.659 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.660 -3.454 24.313 1.00 0.00 H new ATOM 867 N ASP A 59 -7.862 -2.757 24.004 1.00 0.00 N ATOM 868 CA ASP A 59 -7.768 -1.285 23.787 1.00 0.00 C ATOM 869 C ASP A 59 -7.333 -0.585 25.077 1.00 0.00 C ATOM 870 O ASP A 59 -7.861 -0.841 26.141 1.00 0.00 O ATOM 871 CB ASP A 59 -9.180 -0.853 23.391 1.00 0.00 C ATOM 872 CG ASP A 59 -10.182 -1.384 24.416 1.00 0.00 C ATOM 873 OD1 ASP A 59 -10.638 -2.502 24.246 1.00 0.00 O ATOM 874 OD2 ASP A 59 -10.478 -0.662 25.355 1.00 0.00 O ATOM 0 H ASP A 59 -8.371 -3.041 24.841 1.00 0.00 H new ATOM 0 HA ASP A 59 -7.033 -1.026 23.024 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -9.238 0.234 23.339 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -9.423 -1.233 22.399 1.00 0.00 H new ATOM 879 N VAL A 60 -6.375 0.297 24.992 1.00 0.00 N ATOM 880 CA VAL A 60 -5.908 1.011 26.214 1.00 0.00 C ATOM 881 C VAL A 60 -5.759 2.508 25.928 1.00 0.00 C ATOM 882 O VAL A 60 -5.504 2.914 24.812 1.00 0.00 O ATOM 883 CB VAL A 60 -4.550 0.390 26.542 1.00 0.00 C ATOM 884 CG1 VAL A 60 -3.509 0.879 25.534 1.00 0.00 C ATOM 885 CG2 VAL A 60 -4.128 0.807 27.952 1.00 0.00 C ATOM 0 H VAL A 60 -5.896 0.554 24.129 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.610 0.915 27.042 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.624 -0.696 26.490 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.541 0.437 25.767 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.810 0.584 24.529 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.434 1.965 25.587 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.160 0.365 28.188 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.053 1.893 28.003 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.870 0.460 28.671 1.00 0.00 H new ATOM 895 N ALA A 61 -5.916 3.331 26.928 1.00 0.00 N ATOM 896 CA ALA A 61 -5.782 4.800 26.713 1.00 0.00 C ATOM 897 C ALA A 61 -4.409 5.282 27.189 1.00 0.00 C ATOM 898 O ALA A 61 -4.107 5.263 28.366 1.00 0.00 O ATOM 899 CB ALA A 61 -6.892 5.427 27.557 1.00 0.00 C ATOM 0 H ALA A 61 -6.131 3.050 27.885 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.866 5.072 25.661 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -6.860 6.511 27.452 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -7.860 5.058 27.218 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -6.748 5.159 28.604 1.00 0.00 H new ATOM 905 N VAL A 62 -3.574 5.715 26.284 1.00 0.00 N ATOM 906 CA VAL A 62 -2.222 6.197 26.685 1.00 0.00 C ATOM 907 C VAL A 62 -1.800 7.378 25.808 1.00 0.00 C ATOM 908 O VAL A 62 -1.620 7.244 24.614 1.00 0.00 O ATOM 909 CB VAL A 62 -1.292 5.005 26.461 1.00 0.00 C ATOM 910 CG1 VAL A 62 0.079 5.304 27.069 1.00 0.00 C ATOM 911 CG2 VAL A 62 -1.886 3.763 27.132 1.00 0.00 C ATOM 0 H VAL A 62 -3.770 5.756 25.284 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.198 6.544 27.718 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.183 4.826 25.391 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.741 4.453 26.909 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.503 6.189 26.594 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -0.029 5.483 28.139 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -1.224 2.912 26.973 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.994 3.944 28.201 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.863 3.548 26.700 1.00 0.00 H new ATOM 921 N GLY A 63 -1.641 8.535 26.390 1.00 0.00 N ATOM 922 CA GLY A 63 -1.230 9.722 25.588 1.00 0.00 C ATOM 923 C GLY A 63 -0.605 10.771 26.510 1.00 0.00 C ATOM 924 O GLY A 63 0.587 11.005 26.479 1.00 0.00 O ATOM 0 H GLY A 63 -1.778 8.710 27.386 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -0.515 9.425 24.820 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -2.094 10.143 25.074 1.00 0.00 H new ATOM 928 N ALA A 64 -1.398 11.402 27.329 1.00 0.00 N ATOM 929 CA ALA A 64 -0.848 12.434 28.253 1.00 0.00 C ATOM 930 C ALA A 64 -0.280 11.769 29.508 1.00 0.00 C ATOM 931 O ALA A 64 0.599 12.296 30.160 1.00 0.00 O ATOM 932 CB ALA A 64 -2.040 13.323 28.608 1.00 0.00 C ATOM 0 H ALA A 64 -2.404 11.248 27.399 1.00 0.00 H new ATOM 0 HA ALA A 64 -0.036 13.004 27.801 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.716 14.111 29.288 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.443 13.771 27.700 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.811 12.722 29.090 1.00 0.00 H new ATOM 938 N ASN A 65 -0.778 10.613 29.853 1.00 0.00 N ATOM 939 CA ASN A 65 -0.269 9.912 31.067 1.00 0.00 C ATOM 940 C ASN A 65 1.034 9.173 30.749 1.00 0.00 C ATOM 941 O ASN A 65 1.850 8.937 31.617 1.00 0.00 O ATOM 942 CB ASN A 65 -1.371 8.921 31.442 1.00 0.00 C ATOM 943 CG ASN A 65 -1.630 8.991 32.948 1.00 0.00 C ATOM 944 OD1 ASN A 65 -2.134 9.979 33.445 1.00 0.00 O ATOM 945 ND2 ASN A 65 -1.304 7.976 33.702 1.00 0.00 N ATOM 0 H ASN A 65 -1.516 10.123 29.347 1.00 0.00 H new ATOM 0 HA ASN A 65 -0.048 10.604 31.880 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -2.284 9.152 30.894 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -1.077 7.910 31.159 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -1.472 8.013 34.707 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.881 7.146 33.286 1.00 0.00 H new ATOM 952 N ASP A 66 1.234 8.803 29.513 1.00 0.00 N ATOM 953 CA ASP A 66 2.485 8.077 29.149 1.00 0.00 C ATOM 954 C ASP A 66 2.459 7.682 27.669 1.00 0.00 C ATOM 955 O ASP A 66 2.332 6.523 27.329 1.00 0.00 O ATOM 956 CB ASP A 66 2.490 6.831 30.034 1.00 0.00 C ATOM 957 CG ASP A 66 3.896 6.608 30.595 1.00 0.00 C ATOM 958 OD1 ASP A 66 4.263 7.318 31.517 1.00 0.00 O ATOM 959 OD2 ASP A 66 4.581 5.732 30.093 1.00 0.00 O ATOM 0 H ASP A 66 0.588 8.971 28.742 1.00 0.00 H new ATOM 0 HA ASP A 66 3.375 8.689 29.298 1.00 0.00 H new ATOM 0 HB2 ASP A 66 1.776 6.948 30.849 1.00 0.00 H new ATOM 0 HB3 ASP A 66 2.175 5.961 29.457 1.00 0.00 H new ATOM 964 N ALA A 67 2.582 8.635 26.788 1.00 0.00 N ATOM 965 CA ALA A 67 2.566 8.311 25.332 1.00 0.00 C ATOM 966 C ALA A 67 2.872 9.563 24.508 1.00 0.00 C ATOM 967 O ALA A 67 2.675 10.676 24.956 1.00 0.00 O ATOM 968 CB ALA A 67 1.148 7.815 25.052 1.00 0.00 C ATOM 0 H ALA A 67 2.693 9.624 27.012 1.00 0.00 H new ATOM 0 HA ALA A 67 3.317 7.567 25.066 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.055 7.555 23.997 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.943 6.935 25.662 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.433 8.600 25.297 1.00 0.00 H new ATOM 974 N TYR A 68 3.353 9.393 23.307 1.00 0.00 N ATOM 975 CA TYR A 68 3.675 10.576 22.454 1.00 0.00 C ATOM 976 C TYR A 68 2.395 11.333 22.084 1.00 0.00 C ATOM 977 O TYR A 68 2.094 11.533 20.924 1.00 0.00 O ATOM 978 CB TYR A 68 4.345 10.010 21.198 1.00 0.00 C ATOM 979 CG TYR A 68 3.684 8.711 20.795 1.00 0.00 C ATOM 980 CD1 TYR A 68 2.293 8.644 20.645 1.00 0.00 C ATOM 981 CD2 TYR A 68 4.467 7.570 20.572 1.00 0.00 C ATOM 982 CE1 TYR A 68 1.686 7.438 20.272 1.00 0.00 C ATOM 983 CE2 TYR A 68 3.859 6.365 20.200 1.00 0.00 C ATOM 984 CZ TYR A 68 2.469 6.300 20.050 1.00 0.00 C ATOM 985 OH TYR A 68 1.871 5.112 19.684 1.00 0.00 O ATOM 0 H TYR A 68 3.538 8.486 22.878 1.00 0.00 H new ATOM 0 HA TYR A 68 4.324 11.282 22.972 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.275 10.731 20.383 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.406 9.844 21.386 1.00 0.00 H new ATOM 0 HD1 TYR A 68 1.688 9.522 20.817 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.540 7.620 20.687 1.00 0.00 H new ATOM 0 HE1 TYR A 68 0.614 7.387 20.156 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.462 5.486 20.029 1.00 0.00 H new ATOM 0 HH TYR A 68 0.949 5.095 20.015 1.00 0.00 H new ATOM 1100 N VAL A 76 1.899 17.616 37.270 1.00 0.00 N ATOM 1101 CA VAL A 76 1.586 17.492 38.722 1.00 0.00 C ATOM 1102 C VAL A 76 2.696 16.717 39.438 1.00 0.00 C ATOM 1103 O VAL A 76 3.054 15.624 39.046 1.00 0.00 O ATOM 1104 CB VAL A 76 0.268 16.720 38.779 1.00 0.00 C ATOM 1105 CG1 VAL A 76 0.523 15.248 38.451 1.00 0.00 C ATOM 1106 CG2 VAL A 76 -0.326 16.832 40.186 1.00 0.00 C ATOM 0 HA VAL A 76 1.510 18.462 39.213 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.430 17.138 38.053 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.417 14.698 38.492 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.948 15.166 37.451 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.220 14.829 39.177 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.266 16.282 40.229 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.373 16.413 40.910 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.508 17.881 40.422 1.00 0.00 H new ATOM 1116 N GLN A 77 3.245 17.272 40.483 1.00 0.00 N ATOM 1117 CA GLN A 77 4.331 16.564 41.219 1.00 0.00 C ATOM 1118 C GLN A 77 4.311 16.954 42.700 1.00 0.00 C ATOM 1119 O GLN A 77 4.064 18.091 43.049 1.00 0.00 O ATOM 1120 CB GLN A 77 5.628 17.033 40.559 1.00 0.00 C ATOM 1121 CG GLN A 77 6.627 15.875 40.517 1.00 0.00 C ATOM 1122 CD GLN A 77 7.162 15.713 39.093 1.00 0.00 C ATOM 1123 OE1 GLN A 77 6.704 16.371 38.180 1.00 0.00 O ATOM 1124 NE2 GLN A 77 8.119 14.856 38.863 1.00 0.00 N ATOM 0 H GLN A 77 2.989 18.185 40.859 1.00 0.00 H new ATOM 0 HA GLN A 77 4.219 15.481 41.176 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.426 17.390 39.549 1.00 0.00 H new ATOM 0 HB3 GLN A 77 6.049 17.871 41.115 1.00 0.00 H new ATOM 0 HG2 GLN A 77 7.450 16.065 41.206 1.00 0.00 H new ATOM 0 HG3 GLN A 77 6.145 14.953 40.843 1.00 0.00 H new ATOM 0 HE21 GLN A 77 8.504 14.303 39.629 1.00 0.00 H new ATOM 0 HE22 GLN A 77 8.482 14.739 37.917 1.00 0.00 H new ATOM 1133 N ARG A 78 4.569 16.017 43.572 1.00 0.00 N ATOM 1134 CA ARG A 78 4.567 16.334 45.030 1.00 0.00 C ATOM 1135 C ARG A 78 5.877 15.873 45.672 1.00 0.00 C ATOM 1136 O ARG A 78 6.236 14.714 45.609 1.00 0.00 O ATOM 1137 CB ARG A 78 3.384 15.551 45.602 1.00 0.00 C ATOM 1138 CG ARG A 78 2.123 15.868 44.796 1.00 0.00 C ATOM 1139 CD ARG A 78 1.117 16.600 45.686 1.00 0.00 C ATOM 1140 NE ARG A 78 0.263 15.525 46.265 1.00 0.00 N ATOM 1141 CZ ARG A 78 -0.931 15.809 46.709 1.00 0.00 C ATOM 1142 NH1 ARG A 78 -1.240 17.041 47.010 1.00 0.00 N ATOM 1143 NH2 ARG A 78 -1.816 14.861 46.851 1.00 0.00 N ATOM 0 H ARG A 78 4.781 15.047 43.339 1.00 0.00 H new ATOM 0 HA ARG A 78 4.479 17.403 45.221 1.00 0.00 H new ATOM 0 HB2 ARG A 78 3.591 14.481 45.567 1.00 0.00 H new ATOM 0 HB3 ARG A 78 3.234 15.812 46.650 1.00 0.00 H new ATOM 0 HG2 ARG A 78 2.376 16.484 43.933 1.00 0.00 H new ATOM 0 HG3 ARG A 78 1.683 14.947 44.413 1.00 0.00 H new ATOM 0 HD2 ARG A 78 1.621 17.168 46.468 1.00 0.00 H new ATOM 0 HD3 ARG A 78 0.523 17.309 45.110 1.00 0.00 H new ATOM 0 HE ARG A 78 0.611 14.568 46.314 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.548 17.782 46.898 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.173 17.263 47.357 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -1.575 13.898 46.615 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -2.749 15.082 47.198 1.00 0.00 H new ATOM 1157 N VAL A 79 6.596 16.771 46.287 1.00 0.00 N ATOM 1158 CA VAL A 79 7.883 16.382 46.932 1.00 0.00 C ATOM 1159 C VAL A 79 8.022 17.067 48.295 1.00 0.00 C ATOM 1160 O VAL A 79 7.860 18.267 48.407 1.00 0.00 O ATOM 1161 CB VAL A 79 8.968 16.871 45.974 1.00 0.00 C ATOM 1162 CG1 VAL A 79 9.023 15.951 44.753 1.00 0.00 C ATOM 1163 CG2 VAL A 79 8.645 18.297 45.521 1.00 0.00 C ATOM 0 H VAL A 79 6.349 17.757 46.371 1.00 0.00 H new ATOM 0 HA VAL A 79 7.948 15.308 47.109 1.00 0.00 H new ATOM 0 HB VAL A 79 9.932 16.860 46.483 1.00 0.00 H new ATOM 0 HG11 VAL A 79 9.797 16.300 44.069 1.00 0.00 H new ATOM 0 HG12 VAL A 79 9.253 14.935 45.073 1.00 0.00 H new ATOM 0 HG13 VAL A 79 8.059 15.962 44.245 1.00 0.00 H new ATOM 0 HG21 VAL A 79 9.419 18.646 44.838 1.00 0.00 H new ATOM 0 HG22 VAL A 79 7.681 18.308 45.013 1.00 0.00 H new ATOM 0 HG23 VAL A 79 8.605 18.954 46.390 1.00 0.00 H new ATOM 1173 N PRO A 80 8.318 16.275 49.289 1.00 0.00 N ATOM 1174 CA PRO A 80 8.482 16.807 50.665 1.00 0.00 C ATOM 1175 C PRO A 80 9.798 17.581 50.785 1.00 0.00 C ATOM 1176 O PRO A 80 10.648 17.518 49.919 1.00 0.00 O ATOM 1177 CB PRO A 80 8.510 15.551 51.532 1.00 0.00 C ATOM 1178 CG PRO A 80 8.974 14.460 50.620 1.00 0.00 C ATOM 1179 CD PRO A 80 8.527 14.825 49.228 1.00 0.00 C ATOM 0 HA PRO A 80 7.693 17.502 50.954 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.186 15.671 52.379 1.00 0.00 H new ATOM 0 HB3 PRO A 80 7.523 15.331 51.940 1.00 0.00 H new ATOM 0 HG2 PRO A 80 10.058 14.358 50.662 1.00 0.00 H new ATOM 0 HG3 PRO A 80 8.552 13.501 50.921 1.00 0.00 H new ATOM 0 HD2 PRO A 80 9.280 14.562 48.485 1.00 0.00 H new ATOM 0 HD3 PRO A 80 7.611 14.301 48.953 1.00 0.00 H new ATOM 1187 N LYS A 81 9.971 18.312 51.852 1.00 0.00 N ATOM 1188 CA LYS A 81 11.232 19.090 52.026 1.00 0.00 C ATOM 1189 C LYS A 81 12.447 18.186 51.807 1.00 0.00 C ATOM 1190 O LYS A 81 13.510 18.638 51.433 1.00 0.00 O ATOM 1191 CB LYS A 81 11.191 19.593 53.470 1.00 0.00 C ATOM 1192 CG LYS A 81 11.007 18.406 54.419 1.00 0.00 C ATOM 1193 CD LYS A 81 11.071 18.895 55.867 1.00 0.00 C ATOM 1194 CE LYS A 81 11.921 17.928 56.695 1.00 0.00 C ATOM 1195 NZ LYS A 81 13.326 18.370 56.477 1.00 0.00 N ATOM 0 H LYS A 81 9.295 18.405 52.610 1.00 0.00 H new ATOM 0 HA LYS A 81 11.314 19.909 51.311 1.00 0.00 H new ATOM 0 HB2 LYS A 81 12.113 20.123 53.708 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.374 20.303 53.596 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.049 17.921 54.230 1.00 0.00 H new ATOM 0 HG3 LYS A 81 11.782 17.661 54.241 1.00 0.00 H new ATOM 0 HD2 LYS A 81 11.499 19.897 55.905 1.00 0.00 H new ATOM 0 HD3 LYS A 81 10.066 18.962 56.284 1.00 0.00 H new ATOM 0 HE2 LYS A 81 11.653 17.971 57.751 1.00 0.00 H new ATOM 0 HE3 LYS A 81 11.776 16.898 56.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 13.971 17.755 57.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 13.555 18.312 55.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 13.435 19.352 56.801 1.00 0.00 H new ATOM 1209 N ASP A 82 12.298 16.909 52.036 1.00 0.00 N ATOM 1210 CA ASP A 82 13.445 15.977 51.840 1.00 0.00 C ATOM 1211 C ASP A 82 13.903 16.000 50.380 1.00 0.00 C ATOM 1212 O ASP A 82 15.023 15.651 50.064 1.00 0.00 O ATOM 1213 CB ASP A 82 12.901 14.597 52.209 1.00 0.00 C ATOM 1214 CG ASP A 82 12.556 14.565 53.700 1.00 0.00 C ATOM 1215 OD1 ASP A 82 12.787 15.563 54.362 1.00 0.00 O ATOM 1216 OD2 ASP A 82 12.067 13.543 54.153 1.00 0.00 O ATOM 0 H ASP A 82 11.432 16.471 52.350 1.00 0.00 H new ATOM 0 HA ASP A 82 14.308 16.251 52.447 1.00 0.00 H new ATOM 0 HB2 ASP A 82 12.015 14.373 51.615 1.00 0.00 H new ATOM 0 HB3 ASP A 82 13.641 13.830 51.980 1.00 0.00 H new ATOM 1221 N VAL A 83 13.045 16.411 49.486 1.00 0.00 N ATOM 1222 CA VAL A 83 13.434 16.457 48.046 1.00 0.00 C ATOM 1223 C VAL A 83 14.268 17.709 47.762 1.00 0.00 C ATOM 1224 O VAL A 83 14.604 18.000 46.631 1.00 0.00 O ATOM 1225 CB VAL A 83 12.111 16.508 47.281 1.00 0.00 C ATOM 1226 CG1 VAL A 83 12.370 16.948 45.839 1.00 0.00 C ATOM 1227 CG2 VAL A 83 11.468 15.119 47.282 1.00 0.00 C ATOM 0 H VAL A 83 12.093 16.716 49.689 1.00 0.00 H new ATOM 0 HA VAL A 83 14.041 15.600 47.754 1.00 0.00 H new ATOM 0 HB VAL A 83 11.441 17.220 47.763 1.00 0.00 H new ATOM 0 HG11 VAL A 83 11.426 16.984 45.295 1.00 0.00 H new ATOM 0 HG12 VAL A 83 12.828 17.937 45.837 1.00 0.00 H new ATOM 0 HG13 VAL A 83 13.040 16.237 45.356 1.00 0.00 H new ATOM 0 HG21 VAL A 83 10.525 15.154 46.737 1.00 0.00 H new ATOM 0 HG22 VAL A 83 12.139 14.407 46.801 1.00 0.00 H new ATOM 0 HG23 VAL A 83 11.282 14.805 48.309 1.00 0.00 H new ATOM 1237 N PHE A 84 14.606 18.452 48.781 1.00 0.00 N ATOM 1238 CA PHE A 84 15.417 19.684 48.568 1.00 0.00 C ATOM 1239 C PHE A 84 16.748 19.576 49.322 1.00 0.00 C ATOM 1240 O PHE A 84 17.485 18.624 49.160 1.00 0.00 O ATOM 1241 CB PHE A 84 14.565 20.820 49.132 1.00 0.00 C ATOM 1242 CG PHE A 84 13.173 20.743 48.550 1.00 0.00 C ATOM 1243 CD1 PHE A 84 12.995 20.397 47.205 1.00 0.00 C ATOM 1244 CD2 PHE A 84 12.062 21.019 49.355 1.00 0.00 C ATOM 1245 CE1 PHE A 84 11.706 20.326 46.665 1.00 0.00 C ATOM 1246 CE2 PHE A 84 10.772 20.948 48.815 1.00 0.00 C ATOM 1247 CZ PHE A 84 10.594 20.602 47.470 1.00 0.00 C ATOM 0 H PHE A 84 14.356 18.259 49.751 1.00 0.00 H new ATOM 0 HA PHE A 84 15.662 19.845 47.518 1.00 0.00 H new ATOM 0 HB2 PHE A 84 14.521 20.750 50.219 1.00 0.00 H new ATOM 0 HB3 PHE A 84 15.018 21.782 48.893 1.00 0.00 H new ATOM 0 HD1 PHE A 84 13.853 20.185 46.584 1.00 0.00 H new ATOM 0 HD2 PHE A 84 12.200 21.287 50.392 1.00 0.00 H new ATOM 0 HE1 PHE A 84 11.569 20.058 45.628 1.00 0.00 H new ATOM 0 HE2 PHE A 84 9.914 21.160 49.436 1.00 0.00 H new ATOM 0 HZ PHE A 84 9.599 20.548 47.053 1.00 0.00 H new ATOM 1257 N MET A 85 17.061 20.542 50.142 1.00 0.00 N ATOM 1258 CA MET A 85 18.344 20.488 50.901 1.00 0.00 C ATOM 1259 C MET A 85 18.184 21.181 52.256 1.00 0.00 C ATOM 1260 O MET A 85 17.997 20.542 53.273 1.00 0.00 O ATOM 1261 CB MET A 85 19.351 21.238 50.029 1.00 0.00 C ATOM 1262 CG MET A 85 19.924 20.288 48.976 1.00 0.00 C ATOM 1263 SD MET A 85 21.723 20.478 48.906 1.00 0.00 S ATOM 1264 CE MET A 85 22.145 18.979 49.827 1.00 0.00 C ATOM 0 H MET A 85 16.485 21.365 50.319 1.00 0.00 H new ATOM 0 HA MET A 85 18.663 19.466 51.103 1.00 0.00 H new ATOM 0 HB2 MET A 85 18.867 22.086 49.544 1.00 0.00 H new ATOM 0 HB3 MET A 85 20.154 21.640 50.647 1.00 0.00 H new ATOM 0 HG2 MET A 85 19.666 19.258 49.221 1.00 0.00 H new ATOM 0 HG3 MET A 85 19.487 20.503 48.001 1.00 0.00 H new ATOM 0 HE1 MET A 85 23.229 18.894 49.906 1.00 0.00 H new ATOM 0 HE2 MET A 85 21.711 19.031 50.826 1.00 0.00 H new ATOM 0 HE3 MET A 85 21.750 18.108 49.305 1.00 0.00 H new ATOM 1274 N GLY A 86 18.257 22.483 52.280 1.00 0.00 N ATOM 1275 CA GLY A 86 18.110 23.216 53.569 1.00 0.00 C ATOM 1276 C GLY A 86 16.868 24.107 53.511 1.00 0.00 C ATOM 1277 O GLY A 86 16.956 25.294 53.271 1.00 0.00 O ATOM 0 H GLY A 86 18.412 23.072 51.462 1.00 0.00 H new ATOM 0 HA2 GLY A 86 18.025 22.509 54.394 1.00 0.00 H new ATOM 0 HA3 GLY A 86 18.996 23.821 53.758 1.00 0.00 H new ATOM 1281 N VAL A 87 15.711 23.544 53.729 1.00 0.00 N ATOM 1282 CA VAL A 87 14.465 24.361 53.685 1.00 0.00 C ATOM 1283 C VAL A 87 14.303 25.151 54.987 1.00 0.00 C ATOM 1284 O VAL A 87 13.304 25.043 55.670 1.00 0.00 O ATOM 1285 CB VAL A 87 13.332 23.347 53.530 1.00 0.00 C ATOM 1286 CG1 VAL A 87 13.471 22.628 52.186 1.00 0.00 C ATOM 1287 CG2 VAL A 87 13.407 22.323 54.664 1.00 0.00 C ATOM 0 H VAL A 87 15.575 22.554 53.936 1.00 0.00 H new ATOM 0 HA VAL A 87 14.477 25.087 52.872 1.00 0.00 H new ATOM 0 HB VAL A 87 12.373 23.864 53.569 1.00 0.00 H new ATOM 0 HG11 VAL A 87 12.663 21.905 52.075 1.00 0.00 H new ATOM 0 HG12 VAL A 87 13.420 23.356 51.377 1.00 0.00 H new ATOM 0 HG13 VAL A 87 14.429 22.110 52.148 1.00 0.00 H new ATOM 0 HG21 VAL A 87 12.599 21.599 54.555 1.00 0.00 H new ATOM 0 HG22 VAL A 87 14.366 21.806 54.624 1.00 0.00 H new ATOM 0 HG23 VAL A 87 13.309 22.833 55.622 1.00 0.00 H new ATOM 1297 N ASP A 88 15.278 25.945 55.336 1.00 0.00 N ATOM 1298 CA ASP A 88 15.178 26.741 56.592 1.00 0.00 C ATOM 1299 C ASP A 88 13.977 27.688 56.524 1.00 0.00 C ATOM 1300 O ASP A 88 13.503 28.179 57.530 1.00 0.00 O ATOM 1301 CB ASP A 88 16.484 27.534 56.665 1.00 0.00 C ATOM 1302 CG ASP A 88 17.134 27.324 58.033 1.00 0.00 C ATOM 1303 OD1 ASP A 88 16.407 27.278 59.011 1.00 0.00 O ATOM 1304 OD2 ASP A 88 18.348 27.212 58.080 1.00 0.00 O ATOM 0 H ASP A 88 16.139 26.077 54.806 1.00 0.00 H new ATOM 0 HA ASP A 88 15.035 26.111 57.470 1.00 0.00 H new ATOM 0 HB2 ASP A 88 17.162 27.211 55.875 1.00 0.00 H new ATOM 0 HB3 ASP A 88 16.288 28.594 56.503 1.00 0.00 H new ATOM 1309 N GLU A 89 13.482 27.948 55.345 1.00 0.00 N ATOM 1310 CA GLU A 89 12.313 28.864 55.213 1.00 0.00 C ATOM 1311 C GLU A 89 11.658 28.689 53.839 1.00 0.00 C ATOM 1312 O GLU A 89 12.183 29.120 52.831 1.00 0.00 O ATOM 1313 CB GLU A 89 12.892 30.271 55.355 1.00 0.00 C ATOM 1314 CG GLU A 89 12.465 30.866 56.697 1.00 0.00 C ATOM 1315 CD GLU A 89 13.628 30.782 57.687 1.00 0.00 C ATOM 1316 OE1 GLU A 89 14.748 30.595 57.241 1.00 0.00 O ATOM 1317 OE2 GLU A 89 13.379 30.906 58.876 1.00 0.00 O ATOM 0 H GLU A 89 13.836 27.566 54.468 1.00 0.00 H new ATOM 0 HA GLU A 89 11.545 28.663 55.960 1.00 0.00 H new ATOM 0 HB2 GLU A 89 13.980 30.236 55.290 1.00 0.00 H new ATOM 0 HB3 GLU A 89 12.544 30.903 54.538 1.00 0.00 H new ATOM 0 HG2 GLU A 89 12.160 31.904 56.566 1.00 0.00 H new ATOM 0 HG3 GLU A 89 11.602 30.327 57.087 1.00 0.00 H new ATOM 1324 N LEU A 90 10.516 28.058 53.791 1.00 0.00 N ATOM 1325 CA LEU A 90 9.831 27.856 52.483 1.00 0.00 C ATOM 1326 C LEU A 90 8.486 28.590 52.470 1.00 0.00 C ATOM 1327 O LEU A 90 7.747 28.568 53.434 1.00 0.00 O ATOM 1328 CB LEU A 90 9.618 26.346 52.377 1.00 0.00 C ATOM 1329 CG LEU A 90 10.120 25.854 51.018 1.00 0.00 C ATOM 1330 CD1 LEU A 90 11.649 25.907 50.987 1.00 0.00 C ATOM 1331 CD2 LEU A 90 9.657 24.413 50.796 1.00 0.00 C ATOM 0 H LEU A 90 10.028 27.674 54.601 1.00 0.00 H new ATOM 0 HA LEU A 90 10.413 28.246 51.648 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.150 25.836 53.180 1.00 0.00 H new ATOM 0 HB3 LEU A 90 8.561 26.108 52.494 1.00 0.00 H new ATOM 0 HG LEU A 90 9.719 26.492 50.231 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.006 25.556 50.019 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.981 26.933 51.146 1.00 0.00 H new ATOM 0 HD13 LEU A 90 12.051 25.269 51.774 1.00 0.00 H new ATOM 0 HD21 LEU A 90 10.014 24.061 49.828 1.00 0.00 H new ATOM 0 HD22 LEU A 90 10.059 23.776 51.584 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.568 24.373 50.817 1.00 0.00 H new ATOM 1343 N GLN A 91 8.166 29.239 51.384 1.00 0.00 N ATOM 1344 CA GLN A 91 6.870 29.974 51.311 1.00 0.00 C ATOM 1345 C GLN A 91 6.171 29.679 49.981 1.00 0.00 C ATOM 1346 O GLN A 91 6.686 28.966 49.142 1.00 0.00 O ATOM 1347 CB GLN A 91 7.246 31.453 51.402 1.00 0.00 C ATOM 1348 CG GLN A 91 8.162 31.820 50.232 1.00 0.00 C ATOM 1349 CD GLN A 91 8.507 33.309 50.302 1.00 0.00 C ATOM 1350 OE1 GLN A 91 9.060 33.772 51.280 1.00 0.00 O ATOM 1351 NE2 GLN A 91 8.200 34.084 49.297 1.00 0.00 N ATOM 0 H GLN A 91 8.744 29.293 50.545 1.00 0.00 H new ATOM 0 HA GLN A 91 6.183 29.680 52.104 1.00 0.00 H new ATOM 0 HB2 GLN A 91 6.347 32.070 51.381 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.749 31.654 52.348 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.073 31.223 50.268 1.00 0.00 H new ATOM 0 HG3 GLN A 91 7.670 31.594 49.286 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.736 33.695 48.476 1.00 0.00 H new ATOM 0 HE22 GLN A 91 8.424 35.078 49.333 1.00 0.00 H new ATOM 1360 N VAL A 92 5.000 30.221 49.781 1.00 0.00 N ATOM 1361 CA VAL A 92 4.270 29.971 48.505 1.00 0.00 C ATOM 1362 C VAL A 92 4.649 31.027 47.463 1.00 0.00 C ATOM 1363 O VAL A 92 4.805 32.191 47.773 1.00 0.00 O ATOM 1364 CB VAL A 92 2.789 30.083 48.868 1.00 0.00 C ATOM 1365 CG1 VAL A 92 2.411 28.952 49.825 1.00 0.00 C ATOM 1366 CG2 VAL A 92 2.532 31.431 49.545 1.00 0.00 C ATOM 0 H VAL A 92 4.518 30.826 50.446 1.00 0.00 H new ATOM 0 HA VAL A 92 4.512 28.999 48.074 1.00 0.00 H new ATOM 0 HB VAL A 92 2.186 30.009 47.963 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.355 29.032 50.084 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.595 27.991 49.344 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.013 29.025 50.731 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.476 31.512 49.804 1.00 0.00 H new ATOM 0 HG22 VAL A 92 3.135 31.504 50.450 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.801 32.238 48.863 1.00 0.00 H new ATOM 1376 N GLY A 93 4.797 30.629 46.229 1.00 0.00 N ATOM 1377 CA GLY A 93 5.165 31.609 45.169 1.00 0.00 C ATOM 1378 C GLY A 93 6.621 31.389 44.751 1.00 0.00 C ATOM 1379 O GLY A 93 7.081 31.928 43.764 1.00 0.00 O ATOM 0 H GLY A 93 4.679 29.668 45.909 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.507 31.493 44.308 1.00 0.00 H new ATOM 0 HA3 GLY A 93 5.031 32.626 45.537 1.00 0.00 H new ATOM 1383 N MET A 94 7.348 30.601 45.494 1.00 0.00 N ATOM 1384 CA MET A 94 8.774 30.347 45.137 1.00 0.00 C ATOM 1385 C MET A 94 8.864 29.270 44.053 1.00 0.00 C ATOM 1386 O MET A 94 8.406 28.158 44.230 1.00 0.00 O ATOM 1387 CB MET A 94 9.424 29.860 46.432 1.00 0.00 C ATOM 1388 CG MET A 94 10.809 30.494 46.578 1.00 0.00 C ATOM 1389 SD MET A 94 11.236 30.615 48.332 1.00 0.00 S ATOM 1390 CE MET A 94 11.190 28.843 48.700 1.00 0.00 C ATOM 0 H MET A 94 7.018 30.122 46.332 1.00 0.00 H new ATOM 0 HA MET A 94 9.266 31.236 44.742 1.00 0.00 H new ATOM 0 HB2 MET A 94 8.800 30.123 47.286 1.00 0.00 H new ATOM 0 HB3 MET A 94 9.509 28.773 46.422 1.00 0.00 H new ATOM 0 HG2 MET A 94 11.552 29.894 46.052 1.00 0.00 H new ATOM 0 HG3 MET A 94 10.817 31.484 46.122 1.00 0.00 H new ATOM 0 HE1 MET A 94 11.813 28.636 49.570 1.00 0.00 H new ATOM 0 HE2 MET A 94 10.163 28.541 48.908 1.00 0.00 H new ATOM 0 HE3 MET A 94 11.566 28.284 47.843 1.00 0.00 H new ATOM 1400 N ARG A 95 9.451 29.589 42.933 1.00 0.00 N ATOM 1401 CA ARG A 95 9.569 28.583 41.839 1.00 0.00 C ATOM 1402 C ARG A 95 11.029 28.152 41.673 1.00 0.00 C ATOM 1403 O ARG A 95 11.926 28.971 41.631 1.00 0.00 O ATOM 1404 CB ARG A 95 9.075 29.302 40.583 1.00 0.00 C ATOM 1405 CG ARG A 95 7.724 29.959 40.869 1.00 0.00 C ATOM 1406 CD ARG A 95 7.755 31.416 40.401 1.00 0.00 C ATOM 1407 NE ARG A 95 7.711 31.341 38.915 1.00 0.00 N ATOM 1408 CZ ARG A 95 6.670 31.795 38.269 1.00 0.00 C ATOM 1409 NH1 ARG A 95 5.565 31.101 38.243 1.00 0.00 N ATOM 1410 NH2 ARG A 95 6.737 32.941 37.649 1.00 0.00 N ATOM 0 H ARG A 95 9.854 30.503 42.727 1.00 0.00 H new ATOM 0 HA ARG A 95 8.993 27.681 42.044 1.00 0.00 H new ATOM 0 HB2 ARG A 95 9.799 30.055 40.274 1.00 0.00 H new ATOM 0 HB3 ARG A 95 8.980 28.594 39.760 1.00 0.00 H new ATOM 0 HG2 ARG A 95 6.929 29.418 40.356 1.00 0.00 H new ATOM 0 HG3 ARG A 95 7.504 29.913 41.936 1.00 0.00 H new ATOM 0 HD2 ARG A 95 6.906 31.975 40.794 1.00 0.00 H new ATOM 0 HD3 ARG A 95 8.657 31.922 40.745 1.00 0.00 H new ATOM 0 HE ARG A 95 8.493 30.935 38.401 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.514 30.205 38.727 1.00 0.00 H new ATOM 0 HH12 ARG A 95 4.752 31.455 37.739 1.00 0.00 H new ATOM 0 HH21 ARG A 95 7.602 33.482 37.669 1.00 0.00 H new ATOM 0 HH22 ARG A 95 5.925 33.296 37.144 1.00 0.00 H new ATOM 1424 N PHE A 96 11.274 26.874 41.578 1.00 0.00 N ATOM 1425 CA PHE A 96 12.676 26.394 41.415 1.00 0.00 C ATOM 1426 C PHE A 96 12.705 25.120 40.566 1.00 0.00 C ATOM 1427 O PHE A 96 11.694 24.483 40.351 1.00 0.00 O ATOM 1428 CB PHE A 96 13.164 26.105 42.835 1.00 0.00 C ATOM 1429 CG PHE A 96 12.106 25.328 43.582 1.00 0.00 C ATOM 1430 CD1 PHE A 96 11.871 23.984 43.269 1.00 0.00 C ATOM 1431 CD2 PHE A 96 11.363 25.953 44.591 1.00 0.00 C ATOM 1432 CE1 PHE A 96 10.890 23.265 43.962 1.00 0.00 C ATOM 1433 CE2 PHE A 96 10.381 25.233 45.284 1.00 0.00 C ATOM 1434 CZ PHE A 96 10.146 23.889 44.970 1.00 0.00 C ATOM 0 H PHE A 96 10.565 26.142 41.606 1.00 0.00 H new ATOM 0 HA PHE A 96 13.306 27.125 40.909 1.00 0.00 H new ATOM 0 HB2 PHE A 96 14.093 25.536 42.803 1.00 0.00 H new ATOM 0 HB3 PHE A 96 13.379 27.039 43.354 1.00 0.00 H new ATOM 0 HD1 PHE A 96 12.447 23.502 42.493 1.00 0.00 H new ATOM 0 HD2 PHE A 96 11.547 26.989 44.835 1.00 0.00 H new ATOM 0 HE1 PHE A 96 10.707 22.229 43.719 1.00 0.00 H new ATOM 0 HE2 PHE A 96 9.805 25.715 46.060 1.00 0.00 H new ATOM 0 HZ PHE A 96 9.390 23.334 45.506 1.00 0.00 H new ATOM 1444 N LEU A 97 13.858 24.743 40.083 1.00 0.00 N ATOM 1445 CA LEU A 97 13.951 23.511 39.248 1.00 0.00 C ATOM 1446 C LEU A 97 13.979 22.268 40.141 1.00 0.00 C ATOM 1447 O LEU A 97 14.600 22.256 41.186 1.00 0.00 O ATOM 1448 CB LEU A 97 15.267 23.651 38.483 1.00 0.00 C ATOM 1449 CG LEU A 97 15.099 23.087 37.071 1.00 0.00 C ATOM 1450 CD1 LEU A 97 15.481 24.155 36.045 1.00 0.00 C ATOM 1451 CD2 LEU A 97 16.007 21.868 36.899 1.00 0.00 C ATOM 0 H LEU A 97 14.739 25.235 40.230 1.00 0.00 H new ATOM 0 HA LEU A 97 13.099 23.401 38.577 1.00 0.00 H new ATOM 0 HB2 LEU A 97 15.562 24.699 38.435 1.00 0.00 H new ATOM 0 HB3 LEU A 97 16.062 23.120 39.006 1.00 0.00 H new ATOM 0 HG LEU A 97 14.061 22.793 36.919 1.00 0.00 H new ATOM 0 HD11 LEU A 97 15.361 23.753 35.039 1.00 0.00 H new ATOM 0 HD12 LEU A 97 14.835 25.025 36.167 1.00 0.00 H new ATOM 0 HD13 LEU A 97 16.519 24.450 36.196 1.00 0.00 H new ATOM 0 HD21 LEU A 97 15.888 21.465 35.893 1.00 0.00 H new ATOM 0 HD22 LEU A 97 17.045 22.163 37.052 1.00 0.00 H new ATOM 0 HD23 LEU A 97 15.735 21.106 37.630 1.00 0.00 H new ATOM 1463 N ALA A 98 13.310 21.222 39.739 1.00 0.00 N ATOM 1464 CA ALA A 98 13.299 19.981 40.565 1.00 0.00 C ATOM 1465 C ALA A 98 14.125 18.886 39.884 1.00 0.00 C ATOM 1466 O ALA A 98 13.765 18.383 38.839 1.00 0.00 O ATOM 1467 CB ALA A 98 11.828 19.571 40.645 1.00 0.00 C ATOM 0 H ALA A 98 12.771 21.173 38.875 1.00 0.00 H new ATOM 0 HA ALA A 98 13.732 20.138 41.553 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.735 18.662 41.239 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.252 20.370 41.112 1.00 0.00 H new ATOM 0 HB3 ALA A 98 11.446 19.389 39.641 1.00 0.00 H new ATOM 1473 N GLU A 99 15.231 18.515 40.469 1.00 0.00 N ATOM 1474 CA GLU A 99 16.079 17.453 39.855 1.00 0.00 C ATOM 1475 C GLU A 99 15.402 16.086 39.996 1.00 0.00 C ATOM 1476 O GLU A 99 15.528 15.422 41.006 1.00 0.00 O ATOM 1477 CB GLU A 99 17.389 17.487 40.642 1.00 0.00 C ATOM 1478 CG GLU A 99 18.529 16.972 39.761 1.00 0.00 C ATOM 1479 CD GLU A 99 19.162 18.144 39.010 1.00 0.00 C ATOM 1480 OE1 GLU A 99 18.473 19.128 38.797 1.00 0.00 O ATOM 1481 OE2 GLU A 99 20.326 18.038 38.660 1.00 0.00 O ATOM 0 H GLU A 99 15.584 18.901 41.345 1.00 0.00 H new ATOM 0 HA GLU A 99 16.240 17.618 38.790 1.00 0.00 H new ATOM 0 HB2 GLU A 99 17.601 18.504 40.971 1.00 0.00 H new ATOM 0 HB3 GLU A 99 17.303 16.873 41.539 1.00 0.00 H new ATOM 0 HG2 GLU A 99 19.279 16.471 40.374 1.00 0.00 H new ATOM 0 HG3 GLU A 99 18.151 16.234 39.053 1.00 0.00 H new ATOM 1488 N THR A 100 14.685 15.662 38.991 1.00 0.00 N ATOM 1489 CA THR A 100 14.002 14.339 39.070 1.00 0.00 C ATOM 1490 C THR A 100 14.790 13.291 38.281 1.00 0.00 C ATOM 1491 O THR A 100 15.624 13.616 37.460 1.00 0.00 O ATOM 1492 CB THR A 100 12.628 14.565 38.437 1.00 0.00 C ATOM 1493 OG1 THR A 100 12.337 15.955 38.425 1.00 0.00 O ATOM 1494 CG2 THR A 100 11.563 13.826 39.250 1.00 0.00 C ATOM 0 H THR A 100 14.543 16.173 38.120 1.00 0.00 H new ATOM 0 HA THR A 100 13.924 13.974 40.094 1.00 0.00 H new ATOM 0 HB THR A 100 12.631 14.185 37.415 1.00 0.00 H new ATOM 0 HG1 THR A 100 11.458 16.102 38.018 1.00 0.00 H new ATOM 0 HG21 THR A 100 10.584 13.987 38.799 1.00 0.00 H new ATOM 0 HG22 THR A 100 11.787 12.759 39.259 1.00 0.00 H new ATOM 0 HG23 THR A 100 11.558 14.204 40.272 1.00 0.00 H new ATOM 1502 N ASP A 101 14.535 12.034 38.524 1.00 0.00 N ATOM 1503 CA ASP A 101 15.271 10.968 37.787 1.00 0.00 C ATOM 1504 C ASP A 101 15.067 11.130 36.279 1.00 0.00 C ATOM 1505 O ASP A 101 15.909 10.758 35.484 1.00 0.00 O ATOM 1506 CB ASP A 101 14.662 9.652 38.275 1.00 0.00 C ATOM 1507 CG ASP A 101 15.465 8.478 37.714 1.00 0.00 C ATOM 1508 OD1 ASP A 101 16.608 8.690 37.341 1.00 0.00 O ATOM 1509 OD2 ASP A 101 14.925 7.385 37.665 1.00 0.00 O ATOM 0 H ASP A 101 13.849 11.700 39.201 1.00 0.00 H new ATOM 0 HA ASP A 101 16.345 11.009 37.967 1.00 0.00 H new ATOM 0 HB2 ASP A 101 14.664 9.620 39.365 1.00 0.00 H new ATOM 0 HB3 ASP A 101 13.622 9.580 37.956 1.00 0.00 H new ATOM 1514 N GLN A 102 13.958 11.686 35.880 1.00 0.00 N ATOM 1515 CA GLN A 102 13.705 11.877 34.422 1.00 0.00 C ATOM 1516 C GLN A 102 14.599 12.995 33.885 1.00 0.00 C ATOM 1517 O GLN A 102 14.640 13.259 32.700 1.00 0.00 O ATOM 1518 CB GLN A 102 12.230 12.274 34.316 1.00 0.00 C ATOM 1519 CG GLN A 102 11.412 11.488 35.342 1.00 0.00 C ATOM 1520 CD GLN A 102 10.010 11.227 34.788 1.00 0.00 C ATOM 1521 OE1 GLN A 102 9.795 10.268 34.072 1.00 0.00 O ATOM 1522 NE2 GLN A 102 9.039 12.045 35.090 1.00 0.00 N ATOM 0 H GLN A 102 13.216 12.016 36.497 1.00 0.00 H new ATOM 0 HA GLN A 102 13.922 10.980 33.843 1.00 0.00 H new ATOM 0 HB2 GLN A 102 12.118 13.344 34.489 1.00 0.00 H new ATOM 0 HB3 GLN A 102 11.860 12.073 33.310 1.00 0.00 H new ATOM 0 HG2 GLN A 102 11.906 10.543 35.570 1.00 0.00 H new ATOM 0 HG3 GLN A 102 11.347 12.047 36.276 1.00 0.00 H new ATOM 0 HE21 GLN A 102 9.218 12.850 35.691 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.101 11.880 34.726 1.00 0.00 H new ATOM 1531 N GLY A 103 15.315 13.653 34.754 1.00 0.00 N ATOM 1532 CA GLY A 103 16.210 14.756 34.302 1.00 0.00 C ATOM 1533 C GLY A 103 15.810 16.056 34.999 1.00 0.00 C ATOM 1534 O GLY A 103 15.065 16.043 35.960 1.00 0.00 O ATOM 0 H GLY A 103 15.319 13.475 35.758 1.00 0.00 H new ATOM 0 HA2 GLY A 103 17.248 14.513 34.530 1.00 0.00 H new ATOM 0 HA3 GLY A 103 16.141 14.875 33.221 1.00 0.00 H new ATOM 1538 N PRO A 104 16.323 17.142 34.490 1.00 0.00 N ATOM 1539 CA PRO A 104 16.019 18.474 35.067 1.00 0.00 C ATOM 1540 C PRO A 104 14.584 18.890 34.728 1.00 0.00 C ATOM 1541 O PRO A 104 14.234 19.062 33.576 1.00 0.00 O ATOM 1542 CB PRO A 104 17.028 19.396 34.390 1.00 0.00 C ATOM 1543 CG PRO A 104 17.377 18.713 33.106 1.00 0.00 C ATOM 1544 CD PRO A 104 17.226 17.231 33.337 1.00 0.00 C ATOM 0 HA PRO A 104 16.091 18.497 36.154 1.00 0.00 H new ATOM 0 HB2 PRO A 104 16.601 20.383 34.209 1.00 0.00 H new ATOM 0 HB3 PRO A 104 17.911 19.540 35.013 1.00 0.00 H new ATOM 0 HG2 PRO A 104 16.721 19.046 32.302 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.397 18.954 32.806 1.00 0.00 H new ATOM 0 HD2 PRO A 104 16.808 16.731 32.463 1.00 0.00 H new ATOM 0 HD3 PRO A 104 18.186 16.759 33.545 1.00 0.00 H new ATOM 1552 N VAL A 105 13.753 19.052 35.720 1.00 0.00 N ATOM 1553 CA VAL A 105 12.342 19.455 35.453 1.00 0.00 C ATOM 1554 C VAL A 105 11.964 20.661 36.318 1.00 0.00 C ATOM 1555 O VAL A 105 12.112 20.631 37.522 1.00 0.00 O ATOM 1556 CB VAL A 105 11.503 18.237 35.835 1.00 0.00 C ATOM 1557 CG1 VAL A 105 10.019 18.606 35.796 1.00 0.00 C ATOM 1558 CG2 VAL A 105 11.770 17.102 34.844 1.00 0.00 C ATOM 0 H VAL A 105 13.989 18.923 36.704 1.00 0.00 H new ATOM 0 HA VAL A 105 12.185 19.748 34.415 1.00 0.00 H new ATOM 0 HB VAL A 105 11.771 17.914 36.841 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.421 17.737 36.069 1.00 0.00 H new ATOM 0 HG12 VAL A 105 9.826 19.415 36.501 1.00 0.00 H new ATOM 0 HG13 VAL A 105 9.751 18.930 34.790 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.171 16.233 35.116 1.00 0.00 H new ATOM 0 HG22 VAL A 105 11.502 17.426 33.838 1.00 0.00 H new ATOM 0 HG23 VAL A 105 12.827 16.837 34.870 1.00 0.00 H new ATOM 1568 N PRO A 106 11.487 21.687 35.666 1.00 0.00 N ATOM 1569 CA PRO A 106 11.081 22.921 36.381 1.00 0.00 C ATOM 1570 C PRO A 106 9.770 22.693 37.141 1.00 0.00 C ATOM 1571 O PRO A 106 8.909 21.955 36.704 1.00 0.00 O ATOM 1572 CB PRO A 106 10.889 23.938 35.260 1.00 0.00 C ATOM 1573 CG PRO A 106 10.590 23.121 34.042 1.00 0.00 C ATOM 1574 CD PRO A 106 11.282 21.794 34.218 1.00 0.00 C ATOM 0 HA PRO A 106 11.810 23.245 37.124 1.00 0.00 H new ATOM 0 HB2 PRO A 106 10.072 24.624 35.485 1.00 0.00 H new ATOM 0 HB3 PRO A 106 11.784 24.544 35.119 1.00 0.00 H new ATOM 0 HG2 PRO A 106 9.515 22.982 33.925 1.00 0.00 H new ATOM 0 HG3 PRO A 106 10.946 23.625 33.143 1.00 0.00 H new ATOM 0 HD2 PRO A 106 10.672 20.973 33.840 1.00 0.00 H new ATOM 0 HD3 PRO A 106 12.228 21.763 33.678 1.00 0.00 H new ATOM 1582 N VAL A 107 9.613 23.322 38.273 1.00 0.00 N ATOM 1583 CA VAL A 107 8.359 23.140 39.059 1.00 0.00 C ATOM 1584 C VAL A 107 7.960 24.458 39.728 1.00 0.00 C ATOM 1585 O VAL A 107 8.772 25.342 39.916 1.00 0.00 O ATOM 1586 CB VAL A 107 8.699 22.085 40.112 1.00 0.00 C ATOM 1587 CG1 VAL A 107 9.273 20.845 39.425 1.00 0.00 C ATOM 1588 CG2 VAL A 107 9.734 22.654 41.086 1.00 0.00 C ATOM 0 H VAL A 107 10.298 23.954 38.688 1.00 0.00 H new ATOM 0 HA VAL A 107 7.520 22.834 38.434 1.00 0.00 H new ATOM 0 HB VAL A 107 7.796 21.812 40.658 1.00 0.00 H new ATOM 0 HG11 VAL A 107 9.516 20.093 40.176 1.00 0.00 H new ATOM 0 HG12 VAL A 107 8.537 20.440 38.730 1.00 0.00 H new ATOM 0 HG13 VAL A 107 10.176 21.117 38.879 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.978 21.903 41.838 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.637 22.927 40.539 1.00 0.00 H new ATOM 0 HG23 VAL A 107 9.325 23.538 41.576 1.00 0.00 H new ATOM 1598 N GLU A 108 6.713 24.598 40.088 1.00 0.00 N ATOM 1599 CA GLU A 108 6.264 25.860 40.743 1.00 0.00 C ATOM 1600 C GLU A 108 5.523 25.545 42.045 1.00 0.00 C ATOM 1601 O GLU A 108 4.416 25.045 42.036 1.00 0.00 O ATOM 1602 CB GLU A 108 5.320 26.516 39.734 1.00 0.00 C ATOM 1603 CG GLU A 108 6.134 27.093 38.574 1.00 0.00 C ATOM 1604 CD GLU A 108 5.392 26.850 37.259 1.00 0.00 C ATOM 1605 OE1 GLU A 108 4.515 26.003 37.244 1.00 0.00 O ATOM 1606 OE2 GLU A 108 5.713 27.517 36.289 1.00 0.00 O ATOM 0 H GLU A 108 5.987 23.894 39.957 1.00 0.00 H new ATOM 0 HA GLU A 108 7.099 26.511 41.002 1.00 0.00 H new ATOM 0 HB2 GLU A 108 4.604 25.784 39.361 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.746 27.306 40.218 1.00 0.00 H new ATOM 0 HG2 GLU A 108 6.292 28.161 38.723 1.00 0.00 H new ATOM 0 HG3 GLU A 108 7.119 26.627 38.540 1.00 0.00 H new ATOM 1613 N ILE A 109 6.126 25.834 43.165 1.00 0.00 N ATOM 1614 CA ILE A 109 5.457 25.551 44.467 1.00 0.00 C ATOM 1615 C ILE A 109 4.095 26.250 44.524 1.00 0.00 C ATOM 1616 O ILE A 109 3.992 27.444 44.325 1.00 0.00 O ATOM 1617 CB ILE A 109 6.402 26.120 45.526 1.00 0.00 C ATOM 1618 CG1 ILE A 109 6.040 25.543 46.896 1.00 0.00 C ATOM 1619 CG2 ILE A 109 6.270 27.643 45.565 1.00 0.00 C ATOM 1620 CD1 ILE A 109 7.242 24.789 47.465 1.00 0.00 C ATOM 0 H ILE A 109 7.053 26.254 43.235 1.00 0.00 H new ATOM 0 HA ILE A 109 5.271 24.487 44.617 1.00 0.00 H new ATOM 0 HB ILE A 109 7.428 25.851 45.277 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.746 26.344 47.574 1.00 0.00 H new ATOM 0 HG13 ILE A 109 5.186 24.872 46.806 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.944 28.047 46.320 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.528 28.056 44.590 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.243 27.913 45.813 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.985 24.378 48.441 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.515 23.978 46.790 1.00 0.00 H new ATOM 0 HD13 ILE A 109 8.084 25.473 47.570 1.00 0.00 H new ATOM 1632 N THR A 110 3.052 25.516 44.793 1.00 0.00 N ATOM 1633 CA THR A 110 1.698 26.140 44.861 1.00 0.00 C ATOM 1634 C THR A 110 1.160 26.086 46.293 1.00 0.00 C ATOM 1635 O THR A 110 0.272 26.830 46.659 1.00 0.00 O ATOM 1636 CB THR A 110 0.826 25.298 43.927 1.00 0.00 C ATOM 1637 OG1 THR A 110 -0.487 25.838 43.895 1.00 0.00 O ATOM 1638 CG2 THR A 110 0.776 23.856 44.435 1.00 0.00 C ATOM 0 H THR A 110 3.077 24.512 44.969 1.00 0.00 H new ATOM 0 HA THR A 110 1.713 27.190 44.568 1.00 0.00 H new ATOM 0 HB THR A 110 1.249 25.311 42.923 1.00 0.00 H new ATOM 0 HG1 THR A 110 -1.047 25.301 43.296 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.155 23.257 43.769 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.785 23.443 44.459 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.353 23.839 45.439 1.00 0.00 H new ATOM 1646 N ALA A 111 1.689 25.213 47.105 1.00 0.00 N ATOM 1647 CA ALA A 111 1.205 25.115 48.512 1.00 0.00 C ATOM 1648 C ALA A 111 1.950 24.001 49.252 1.00 0.00 C ATOM 1649 O ALA A 111 2.245 22.962 48.695 1.00 0.00 O ATOM 1650 CB ALA A 111 -0.283 24.780 48.396 1.00 0.00 C ATOM 0 H ALA A 111 2.435 24.563 46.856 1.00 0.00 H new ATOM 0 HA ALA A 111 1.374 26.035 49.072 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -0.715 24.691 49.393 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -0.793 25.573 47.850 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -0.403 23.837 47.863 1.00 0.00 H new ATOM 1656 N VAL A 112 2.255 24.208 50.503 1.00 0.00 N ATOM 1657 CA VAL A 112 2.981 23.161 51.277 1.00 0.00 C ATOM 1658 C VAL A 112 1.984 22.191 51.918 1.00 0.00 C ATOM 1659 O VAL A 112 1.255 22.543 52.824 1.00 0.00 O ATOM 1660 CB VAL A 112 3.753 23.925 52.353 1.00 0.00 C ATOM 1661 CG1 VAL A 112 2.768 24.550 53.343 1.00 0.00 C ATOM 1662 CG2 VAL A 112 4.680 22.961 53.096 1.00 0.00 C ATOM 0 H VAL A 112 2.033 25.057 51.023 1.00 0.00 H new ATOM 0 HA VAL A 112 3.643 22.567 50.647 1.00 0.00 H new ATOM 0 HB VAL A 112 4.345 24.712 51.885 1.00 0.00 H new ATOM 0 HG11 VAL A 112 3.319 25.094 54.110 1.00 0.00 H new ATOM 0 HG12 VAL A 112 2.107 25.237 52.814 1.00 0.00 H new ATOM 0 HG13 VAL A 112 2.175 23.764 53.811 1.00 0.00 H new ATOM 0 HG21 VAL A 112 5.231 23.505 53.863 1.00 0.00 H new ATOM 0 HG22 VAL A 112 4.088 22.174 53.563 1.00 0.00 H new ATOM 0 HG23 VAL A 112 5.383 22.516 52.391 1.00 0.00 H new ATOM 1672 N GLU A 113 1.944 20.972 51.452 1.00 0.00 N ATOM 1673 CA GLU A 113 0.993 19.982 52.034 1.00 0.00 C ATOM 1674 C GLU A 113 1.596 19.344 53.289 1.00 0.00 C ATOM 1675 O GLU A 113 2.759 19.523 53.591 1.00 0.00 O ATOM 1676 CB GLU A 113 0.795 18.933 50.941 1.00 0.00 C ATOM 1677 CG GLU A 113 -0.509 19.215 50.191 1.00 0.00 C ATOM 1678 CD GLU A 113 -1.657 18.456 50.859 1.00 0.00 C ATOM 1679 OE1 GLU A 113 -1.396 17.410 51.430 1.00 0.00 O ATOM 1680 OE2 GLU A 113 -2.777 18.933 50.788 1.00 0.00 O ATOM 0 H GLU A 113 2.528 20.619 50.694 1.00 0.00 H new ATOM 0 HA GLU A 113 0.051 20.441 52.333 1.00 0.00 H new ATOM 0 HB2 GLU A 113 1.636 18.951 50.248 1.00 0.00 H new ATOM 0 HB3 GLU A 113 0.766 17.936 51.380 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -0.717 20.285 50.192 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -0.415 18.910 49.149 1.00 0.00 H new ATOM 1687 N ASP A 114 0.812 18.602 54.022 1.00 0.00 N ATOM 1688 CA ASP A 114 1.340 17.954 55.258 1.00 0.00 C ATOM 1689 C ASP A 114 2.151 16.706 54.897 1.00 0.00 C ATOM 1690 O ASP A 114 1.745 15.905 54.079 1.00 0.00 O ATOM 1691 CB ASP A 114 0.099 17.572 56.065 1.00 0.00 C ATOM 1692 CG ASP A 114 -0.246 18.703 57.036 1.00 0.00 C ATOM 1693 OD1 ASP A 114 0.671 19.357 57.503 1.00 0.00 O ATOM 1694 OD2 ASP A 114 -1.423 18.894 57.296 1.00 0.00 O ATOM 0 H ASP A 114 -0.170 18.416 53.820 1.00 0.00 H new ATOM 0 HA ASP A 114 2.004 18.612 55.818 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -0.740 17.385 55.395 1.00 0.00 H new ATOM 0 HB3 ASP A 114 0.280 16.649 56.615 1.00 0.00 H new ATOM 1699 N ASP A 115 3.296 16.537 55.505 1.00 0.00 N ATOM 1700 CA ASP A 115 4.141 15.341 55.206 1.00 0.00 C ATOM 1701 C ASP A 115 4.810 15.484 53.835 1.00 0.00 C ATOM 1702 O ASP A 115 5.618 14.666 53.443 1.00 0.00 O ATOM 1703 CB ASP A 115 3.175 14.155 55.214 1.00 0.00 C ATOM 1704 CG ASP A 115 3.877 12.929 55.801 1.00 0.00 C ATOM 1705 OD1 ASP A 115 4.266 12.991 56.956 1.00 0.00 O ATOM 1706 OD2 ASP A 115 4.015 11.950 55.087 1.00 0.00 O ATOM 0 H ASP A 115 3.684 17.177 56.198 1.00 0.00 H new ATOM 0 HA ASP A 115 4.943 15.216 55.933 1.00 0.00 H new ATOM 0 HB2 ASP A 115 2.290 14.397 55.803 1.00 0.00 H new ATOM 0 HB3 ASP A 115 2.835 13.942 54.200 1.00 0.00 H new ATOM 1711 N HIS A 116 4.482 16.513 53.102 1.00 0.00 N ATOM 1712 CA HIS A 116 5.105 16.699 51.759 1.00 0.00 C ATOM 1713 C HIS A 116 4.656 18.027 51.145 1.00 0.00 C ATOM 1714 O HIS A 116 3.642 18.583 51.519 1.00 0.00 O ATOM 1715 CB HIS A 116 4.604 15.521 50.921 1.00 0.00 C ATOM 1716 CG HIS A 116 3.102 15.549 50.860 1.00 0.00 C ATOM 1717 ND1 HIS A 116 2.317 14.637 51.548 1.00 0.00 N ATOM 1718 CD2 HIS A 116 2.226 16.370 50.194 1.00 0.00 C ATOM 1719 CE1 HIS A 116 1.031 14.928 51.283 1.00 0.00 C ATOM 1720 NE2 HIS A 116 0.919 15.975 50.462 1.00 0.00 N ATOM 0 H HIS A 116 3.811 17.232 53.374 1.00 0.00 H new ATOM 0 HA HIS A 116 6.193 16.727 51.810 1.00 0.00 H new ATOM 0 HB2 HIS A 116 5.020 15.574 49.915 1.00 0.00 H new ATOM 0 HB3 HIS A 116 4.943 14.581 51.357 1.00 0.00 H new ATOM 0 HD2 HIS A 116 2.508 17.197 49.559 1.00 0.00 H new ATOM 0 HE1 HIS A 116 0.191 14.381 51.685 1.00 0.00 H new ATOM 0 HE2 HIS A 116 0.060 16.395 50.107 1.00 0.00 H new ATOM 1728 N VAL A 117 5.404 18.540 50.207 1.00 0.00 N ATOM 1729 CA VAL A 117 5.020 19.832 49.570 1.00 0.00 C ATOM 1730 C VAL A 117 4.337 19.578 48.224 1.00 0.00 C ATOM 1731 O VAL A 117 4.258 18.457 47.759 1.00 0.00 O ATOM 1732 CB VAL A 117 6.338 20.581 49.369 1.00 0.00 C ATOM 1733 CG1 VAL A 117 6.049 22.047 49.043 1.00 0.00 C ATOM 1734 CG2 VAL A 117 7.171 20.499 50.651 1.00 0.00 C ATOM 0 H VAL A 117 6.264 18.121 49.854 1.00 0.00 H new ATOM 0 HA VAL A 117 4.317 20.399 50.180 1.00 0.00 H new ATOM 0 HB VAL A 117 6.890 20.128 48.545 1.00 0.00 H new ATOM 0 HG11 VAL A 117 6.989 22.580 48.900 1.00 0.00 H new ATOM 0 HG12 VAL A 117 5.455 22.107 48.131 1.00 0.00 H new ATOM 0 HG13 VAL A 117 5.496 22.501 49.866 1.00 0.00 H new ATOM 0 HG21 VAL A 117 8.111 21.033 50.509 1.00 0.00 H new ATOM 0 HG22 VAL A 117 6.618 20.951 51.474 1.00 0.00 H new ATOM 0 HG23 VAL A 117 7.378 19.455 50.884 1.00 0.00 H new ATOM 1744 N VAL A 118 3.846 20.608 47.593 1.00 0.00 N ATOM 1745 CA VAL A 118 3.170 20.426 46.276 1.00 0.00 C ATOM 1746 C VAL A 118 3.799 21.347 45.228 1.00 0.00 C ATOM 1747 O VAL A 118 4.170 22.469 45.516 1.00 0.00 O ATOM 1748 CB VAL A 118 1.712 20.810 46.523 1.00 0.00 C ATOM 1749 CG1 VAL A 118 0.937 20.750 45.205 1.00 0.00 C ATOM 1750 CG2 VAL A 118 1.089 19.833 47.524 1.00 0.00 C ATOM 0 H VAL A 118 3.883 21.569 47.932 1.00 0.00 H new ATOM 0 HA VAL A 118 3.264 19.407 45.900 1.00 0.00 H new ATOM 0 HB VAL A 118 1.667 21.822 46.925 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.103 21.024 45.382 1.00 0.00 H new ATOM 0 HG12 VAL A 118 1.379 21.445 44.491 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.982 19.738 44.802 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.049 20.107 47.700 1.00 0.00 H new ATOM 0 HG22 VAL A 118 1.135 18.821 47.121 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.640 19.875 48.464 1.00 0.00 H new ATOM 1760 N VAL A 119 3.923 20.884 44.014 1.00 0.00 N ATOM 1761 CA VAL A 119 4.530 21.735 42.950 1.00 0.00 C ATOM 1762 C VAL A 119 4.190 21.174 41.566 1.00 0.00 C ATOM 1763 O VAL A 119 4.300 19.989 41.322 1.00 0.00 O ATOM 1764 CB VAL A 119 6.037 21.672 43.207 1.00 0.00 C ATOM 1765 CG1 VAL A 119 6.608 20.378 42.623 1.00 0.00 C ATOM 1766 CG2 VAL A 119 6.716 22.873 42.546 1.00 0.00 C ATOM 0 H VAL A 119 3.631 19.954 43.713 1.00 0.00 H new ATOM 0 HA VAL A 119 4.157 22.759 42.973 1.00 0.00 H new ATOM 0 HB VAL A 119 6.221 21.693 44.281 1.00 0.00 H new ATOM 0 HG11 VAL A 119 7.681 20.338 42.808 1.00 0.00 H new ATOM 0 HG12 VAL A 119 6.126 19.522 43.095 1.00 0.00 H new ATOM 0 HG13 VAL A 119 6.424 20.351 41.549 1.00 0.00 H new ATOM 0 HG21 VAL A 119 7.790 22.830 42.728 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.529 22.851 41.472 1.00 0.00 H new ATOM 0 HG23 VAL A 119 6.314 23.795 42.966 1.00 0.00 H new ATOM 1776 N ASP A 120 3.775 22.016 40.660 1.00 0.00 N ATOM 1777 CA ASP A 120 3.427 21.530 39.294 1.00 0.00 C ATOM 1778 C ASP A 120 4.402 22.102 38.262 1.00 0.00 C ATOM 1779 O ASP A 120 5.212 22.956 38.564 1.00 0.00 O ATOM 1780 CB ASP A 120 2.010 22.047 39.039 1.00 0.00 C ATOM 1781 CG ASP A 120 2.036 23.573 38.928 1.00 0.00 C ATOM 1782 OD1 ASP A 120 2.519 24.067 37.922 1.00 0.00 O ATOM 1783 OD2 ASP A 120 1.571 24.222 39.850 1.00 0.00 O ATOM 0 H ASP A 120 3.662 23.019 40.806 1.00 0.00 H new ATOM 0 HA ASP A 120 3.485 20.444 39.215 1.00 0.00 H new ATOM 0 HB2 ASP A 120 1.612 21.612 38.122 1.00 0.00 H new ATOM 0 HB3 ASP A 120 1.349 21.742 39.850 1.00 0.00 H new ATOM 1896 N ASN A 129 -5.062 12.820 26.672 1.00 0.00 N ATOM 1897 CA ASN A 129 -4.974 11.335 26.555 1.00 0.00 C ATOM 1898 C ASN A 129 -5.811 10.843 25.372 1.00 0.00 C ATOM 1899 O ASN A 129 -6.876 11.358 25.094 1.00 0.00 O ATOM 1900 CB ASN A 129 -5.540 10.801 27.871 1.00 0.00 C ATOM 1901 CG ASN A 129 -4.793 11.439 29.044 1.00 0.00 C ATOM 1902 OD1 ASN A 129 -5.035 12.578 29.386 1.00 0.00 O ATOM 1903 ND2 ASN A 129 -3.888 10.745 29.680 1.00 0.00 N ATOM 0 HA ASN A 129 -3.953 10.996 26.381 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -6.605 11.025 27.939 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -5.440 9.716 27.909 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -3.385 11.160 30.464 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -3.684 9.788 29.393 1.00 0.00 H new ATOM 1910 N LEU A 130 -5.338 9.848 24.673 1.00 0.00 N ATOM 1911 CA LEU A 130 -6.105 9.320 23.508 1.00 0.00 C ATOM 1912 C LEU A 130 -6.273 7.802 23.629 1.00 0.00 C ATOM 1913 O LEU A 130 -5.683 7.169 24.482 1.00 0.00 O ATOM 1914 CB LEU A 130 -5.257 9.669 22.283 1.00 0.00 C ATOM 1915 CG LEU A 130 -3.790 9.337 22.565 1.00 0.00 C ATOM 1916 CD1 LEU A 130 -3.159 8.717 21.318 1.00 0.00 C ATOM 1917 CD2 LEU A 130 -3.041 10.619 22.931 1.00 0.00 C ATOM 0 H LEU A 130 -4.452 9.377 24.858 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.106 9.747 23.446 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -5.607 9.111 21.415 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -5.362 10.727 22.045 1.00 0.00 H new ATOM 0 HG LEU A 130 -3.729 8.630 23.392 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -2.114 8.480 21.518 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -3.694 7.804 21.055 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -3.219 9.424 20.490 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -1.996 10.385 23.132 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -3.102 11.325 22.103 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -3.491 11.062 23.819 1.00 0.00 H new ATOM 1929 N LYS A 131 -7.073 7.214 22.783 1.00 0.00 N ATOM 1930 CA LYS A 131 -7.277 5.738 22.851 1.00 0.00 C ATOM 1931 C LYS A 131 -6.258 5.023 21.959 1.00 0.00 C ATOM 1932 O LYS A 131 -5.971 5.455 20.860 1.00 0.00 O ATOM 1933 CB LYS A 131 -8.697 5.508 22.331 1.00 0.00 C ATOM 1934 CG LYS A 131 -9.655 5.359 23.515 1.00 0.00 C ATOM 1935 CD LYS A 131 -9.942 3.875 23.757 1.00 0.00 C ATOM 1936 CE LYS A 131 -10.229 3.645 25.241 1.00 0.00 C ATOM 1937 NZ LYS A 131 -9.165 2.708 25.698 1.00 0.00 N ATOM 0 H LYS A 131 -7.595 7.691 22.047 1.00 0.00 H new ATOM 0 HA LYS A 131 -7.145 5.350 23.861 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -9.006 6.343 21.703 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -8.728 4.613 21.709 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -9.218 5.806 24.408 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -10.584 5.892 23.314 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.795 3.556 23.157 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -9.089 3.273 23.443 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -10.197 4.581 25.799 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -11.221 3.219 25.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -9.468 2.240 26.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -8.996 1.991 24.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -8.287 3.238 25.873 1.00 0.00 H new ATOM 1951 N PHE A 132 -5.705 3.936 22.425 1.00 0.00 N ATOM 1952 CA PHE A 132 -4.702 3.200 21.602 1.00 0.00 C ATOM 1953 C PHE A 132 -4.997 1.697 21.620 1.00 0.00 C ATOM 1954 O PHE A 132 -4.801 1.030 22.617 1.00 0.00 O ATOM 1955 CB PHE A 132 -3.357 3.491 22.267 1.00 0.00 C ATOM 1956 CG PHE A 132 -2.245 3.286 21.266 1.00 0.00 C ATOM 1957 CD1 PHE A 132 -1.869 4.331 20.414 1.00 0.00 C ATOM 1958 CD2 PHE A 132 -1.590 2.051 21.190 1.00 0.00 C ATOM 1959 CE1 PHE A 132 -0.837 4.142 19.487 1.00 0.00 C ATOM 1960 CE2 PHE A 132 -0.559 1.860 20.262 1.00 0.00 C ATOM 1961 CZ PHE A 132 -0.182 2.907 19.411 1.00 0.00 C ATOM 0 H PHE A 132 -5.904 3.526 23.338 1.00 0.00 H new ATOM 0 HA PHE A 132 -4.718 3.511 20.557 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -3.339 4.514 22.642 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -3.214 2.834 23.125 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -2.375 5.283 20.472 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -1.880 1.245 21.848 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -0.546 4.949 18.831 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -0.055 0.907 20.202 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.614 2.761 18.696 1.00 0.00 H new ATOM 1971 N ASN A 133 -5.462 1.160 20.526 1.00 0.00 N ATOM 1972 CA ASN A 133 -5.764 -0.299 20.480 1.00 0.00 C ATOM 1973 C ASN A 133 -4.508 -1.080 20.087 1.00 0.00 C ATOM 1974 O ASN A 133 -3.579 -0.536 19.524 1.00 0.00 O ATOM 1975 CB ASN A 133 -6.845 -0.449 19.409 1.00 0.00 C ATOM 1976 CG ASN A 133 -8.009 0.492 19.723 1.00 0.00 C ATOM 1977 OD1 ASN A 133 -8.763 0.860 18.844 1.00 0.00 O ATOM 1978 ND2 ASN A 133 -8.189 0.902 20.949 1.00 0.00 N ATOM 0 H ASN A 133 -5.646 1.669 19.661 1.00 0.00 H new ATOM 0 HA ASN A 133 -6.093 -0.685 21.445 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -6.433 -0.219 18.427 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -7.196 -1.480 19.374 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -8.962 1.531 21.168 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -7.557 0.594 21.688 1.00 0.00 H new ATOM 1985 N VAL A 134 -4.468 -2.352 20.380 1.00 0.00 N ATOM 1986 CA VAL A 134 -3.266 -3.158 20.021 1.00 0.00 C ATOM 1987 C VAL A 134 -3.644 -4.629 19.826 1.00 0.00 C ATOM 1988 O VAL A 134 -4.658 -5.091 20.311 1.00 0.00 O ATOM 1989 CB VAL A 134 -2.317 -3.001 21.208 1.00 0.00 C ATOM 1990 CG1 VAL A 134 -1.046 -3.814 20.956 1.00 0.00 C ATOM 1991 CG2 VAL A 134 -1.952 -1.524 21.377 1.00 0.00 C ATOM 0 H VAL A 134 -5.213 -2.866 20.851 1.00 0.00 H new ATOM 0 HA VAL A 134 -2.813 -2.825 19.087 1.00 0.00 H new ATOM 0 HB VAL A 134 -2.805 -3.361 22.114 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -0.369 -3.702 21.803 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.305 -4.866 20.835 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -0.557 -3.454 20.051 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -1.275 -1.411 22.224 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -1.464 -1.164 20.471 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -2.857 -0.944 21.556 1.00 0.00 H new ATOM 2001 N GLU A 135 -2.832 -5.368 19.120 1.00 0.00 N ATOM 2002 CA GLU A 135 -3.136 -6.810 18.891 1.00 0.00 C ATOM 2003 C GLU A 135 -1.832 -7.598 18.734 1.00 0.00 C ATOM 2004 O GLU A 135 -1.008 -7.289 17.896 1.00 0.00 O ATOM 2005 CB GLU A 135 -3.944 -6.846 17.593 1.00 0.00 C ATOM 2006 CG GLU A 135 -5.059 -5.801 17.655 1.00 0.00 C ATOM 2007 CD GLU A 135 -5.936 -5.914 16.407 1.00 0.00 C ATOM 2008 OE1 GLU A 135 -5.590 -6.693 15.534 1.00 0.00 O ATOM 2009 OE2 GLU A 135 -6.939 -5.223 16.347 1.00 0.00 O ATOM 0 H GLU A 135 -1.969 -5.035 18.691 1.00 0.00 H new ATOM 0 HA GLU A 135 -3.684 -7.256 19.721 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -3.293 -6.648 16.742 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -4.370 -7.839 17.445 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -5.662 -5.950 18.551 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -4.631 -4.801 17.722 1.00 0.00 H new ATOM 2016 N VAL A 136 -1.635 -8.610 19.534 1.00 0.00 N ATOM 2017 CA VAL A 136 -0.380 -9.410 19.429 1.00 0.00 C ATOM 2018 C VAL A 136 -0.497 -10.443 18.307 1.00 0.00 C ATOM 2019 O VAL A 136 -1.521 -11.074 18.133 1.00 0.00 O ATOM 2020 CB VAL A 136 -0.236 -10.102 20.784 1.00 0.00 C ATOM 2021 CG1 VAL A 136 1.148 -10.744 20.886 1.00 0.00 C ATOM 2022 CG2 VAL A 136 -0.404 -9.071 21.903 1.00 0.00 C ATOM 0 H VAL A 136 -2.287 -8.918 20.255 1.00 0.00 H new ATOM 0 HA VAL A 136 0.484 -8.789 19.194 1.00 0.00 H new ATOM 0 HB VAL A 136 -1.001 -10.873 20.881 1.00 0.00 H new ATOM 0 HG11 VAL A 136 1.250 -11.237 21.853 1.00 0.00 H new ATOM 0 HG12 VAL A 136 1.268 -11.478 20.089 1.00 0.00 H new ATOM 0 HG13 VAL A 136 1.914 -9.975 20.789 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.301 -9.564 22.870 1.00 0.00 H new ATOM 0 HG22 VAL A 136 0.361 -8.300 21.805 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -1.391 -8.614 21.831 1.00 0.00 H new ATOM 2032 N VAL A 137 0.547 -10.621 17.543 1.00 0.00 N ATOM 2033 CA VAL A 137 0.497 -11.613 16.431 1.00 0.00 C ATOM 2034 C VAL A 137 1.423 -12.797 16.730 1.00 0.00 C ATOM 2035 O VAL A 137 1.114 -13.930 16.419 1.00 0.00 O ATOM 2036 CB VAL A 137 0.982 -10.853 15.197 1.00 0.00 C ATOM 2037 CG1 VAL A 137 0.768 -11.713 13.950 1.00 0.00 C ATOM 2038 CG2 VAL A 137 0.190 -9.551 15.058 1.00 0.00 C ATOM 0 H VAL A 137 1.432 -10.123 17.641 1.00 0.00 H new ATOM 0 HA VAL A 137 -0.504 -12.022 16.291 1.00 0.00 H new ATOM 0 HB VAL A 137 2.043 -10.626 15.304 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.114 -11.171 13.070 1.00 0.00 H new ATOM 0 HG12 VAL A 137 1.330 -12.642 14.048 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -0.293 -11.940 13.842 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.535 -9.008 14.178 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -0.870 -9.780 14.951 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.341 -8.937 15.946 1.00 0.00 H new ATOM 2048 N ALA A 138 2.557 -12.546 17.330 1.00 0.00 N ATOM 2049 CA ALA A 138 3.494 -13.665 17.640 1.00 0.00 C ATOM 2050 C ALA A 138 4.461 -13.260 18.756 1.00 0.00 C ATOM 2051 O ALA A 138 4.498 -12.120 19.176 1.00 0.00 O ATOM 2052 CB ALA A 138 4.255 -13.914 16.337 1.00 0.00 C ATOM 0 H ALA A 138 2.873 -11.620 17.617 1.00 0.00 H new ATOM 0 HA ALA A 138 2.970 -14.556 17.986 1.00 0.00 H new ATOM 0 HB1 ALA A 138 4.968 -14.726 16.481 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.551 -14.185 15.550 1.00 0.00 H new ATOM 0 HB3 ALA A 138 4.790 -13.009 16.049 1.00 0.00 H new ATOM 2058 N ILE A 139 5.246 -14.186 19.236 1.00 0.00 N ATOM 2059 CA ILE A 139 6.213 -13.857 20.323 1.00 0.00 C ATOM 2060 C ILE A 139 7.361 -14.871 20.331 1.00 0.00 C ATOM 2061 O ILE A 139 7.218 -15.981 20.804 1.00 0.00 O ATOM 2062 CB ILE A 139 5.405 -13.950 21.617 1.00 0.00 C ATOM 2063 CG1 ILE A 139 4.382 -12.811 21.659 1.00 0.00 C ATOM 2064 CG2 ILE A 139 6.348 -13.836 22.817 1.00 0.00 C ATOM 2065 CD1 ILE A 139 3.931 -12.574 23.102 1.00 0.00 C ATOM 0 H ILE A 139 5.260 -15.157 18.923 1.00 0.00 H new ATOM 0 HA ILE A 139 6.660 -12.871 20.194 1.00 0.00 H new ATOM 0 HB ILE A 139 4.886 -14.908 21.655 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.821 -11.900 21.251 1.00 0.00 H new ATOM 0 HG13 ILE A 139 3.523 -13.058 21.035 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.772 -13.902 23.740 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.077 -14.646 22.785 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.868 -12.879 22.782 1.00 0.00 H new ATOM 0 HD11 ILE A 139 3.203 -11.763 23.127 1.00 0.00 H new ATOM 0 HD12 ILE A 139 3.475 -13.483 23.495 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.793 -12.307 23.713 1.00 0.00 H new ATOM 2077 N ARG A 140 8.499 -14.498 19.811 1.00 0.00 N ATOM 2078 CA ARG A 140 9.654 -15.440 19.788 1.00 0.00 C ATOM 2079 C ARG A 140 10.861 -14.818 20.497 1.00 0.00 C ATOM 2080 O ARG A 140 10.932 -13.619 20.684 1.00 0.00 O ATOM 2081 CB ARG A 140 9.956 -15.658 18.305 1.00 0.00 C ATOM 2082 CG ARG A 140 11.219 -16.511 18.159 1.00 0.00 C ATOM 2083 CD ARG A 140 10.926 -17.943 18.612 1.00 0.00 C ATOM 2084 NE ARG A 140 12.252 -18.503 18.992 1.00 0.00 N ATOM 2085 CZ ARG A 140 12.921 -19.230 18.140 1.00 0.00 C ATOM 2086 NH1 ARG A 140 12.924 -18.915 16.874 1.00 0.00 N ATOM 2087 NH2 ARG A 140 13.587 -20.274 18.553 1.00 0.00 N ATOM 0 H ARG A 140 8.679 -13.581 19.401 1.00 0.00 H new ATOM 0 HA ARG A 140 9.434 -16.376 20.302 1.00 0.00 H new ATOM 0 HB2 ARG A 140 9.113 -16.151 17.820 1.00 0.00 H new ATOM 0 HB3 ARG A 140 10.093 -14.698 17.806 1.00 0.00 H new ATOM 0 HG2 ARG A 140 11.554 -16.508 17.122 1.00 0.00 H new ATOM 0 HG3 ARG A 140 12.027 -16.088 18.756 1.00 0.00 H new ATOM 0 HD2 ARG A 140 10.235 -17.957 19.455 1.00 0.00 H new ATOM 0 HD3 ARG A 140 10.466 -18.524 17.813 1.00 0.00 H new ATOM 0 HE ARG A 140 12.637 -18.318 19.918 1.00 0.00 H new ATOM 0 HH11 ARG A 140 12.403 -18.100 16.550 1.00 0.00 H new ATOM 0 HH12 ARG A 140 13.447 -19.484 16.208 1.00 0.00 H new ATOM 0 HH21 ARG A 140 13.585 -20.522 19.542 1.00 0.00 H new ATOM 0 HH22 ARG A 140 14.110 -20.842 17.886 1.00 0.00 H new ATOM 2101 N GLU A 141 11.809 -15.622 20.893 1.00 0.00 N ATOM 2102 CA GLU A 141 13.009 -15.075 21.590 1.00 0.00 C ATOM 2103 C GLU A 141 14.050 -14.608 20.567 1.00 0.00 C ATOM 2104 O GLU A 141 14.262 -15.239 19.551 1.00 0.00 O ATOM 2105 CB GLU A 141 13.554 -16.241 22.415 1.00 0.00 C ATOM 2106 CG GLU A 141 14.323 -15.699 23.621 1.00 0.00 C ATOM 2107 CD GLU A 141 15.697 -16.367 23.694 1.00 0.00 C ATOM 2108 OE1 GLU A 141 15.745 -17.540 24.026 1.00 0.00 O ATOM 2109 OE2 GLU A 141 16.676 -15.696 23.416 1.00 0.00 O ATOM 0 H GLU A 141 11.805 -16.634 20.765 1.00 0.00 H new ATOM 0 HA GLU A 141 12.767 -14.213 22.212 1.00 0.00 H new ATOM 0 HB2 GLU A 141 12.735 -16.878 22.749 1.00 0.00 H new ATOM 0 HB3 GLU A 141 14.209 -16.860 21.801 1.00 0.00 H new ATOM 0 HG2 GLU A 141 14.437 -14.618 23.537 1.00 0.00 H new ATOM 0 HG3 GLU A 141 13.765 -15.891 24.537 1.00 0.00 H new ATOM 2116 N ALA A 142 14.702 -13.507 20.830 1.00 0.00 N ATOM 2117 CA ALA A 142 15.728 -13.003 19.873 1.00 0.00 C ATOM 2118 C ALA A 142 17.111 -13.539 20.254 1.00 0.00 C ATOM 2119 O ALA A 142 17.326 -14.002 21.357 1.00 0.00 O ATOM 2120 CB ALA A 142 15.687 -11.480 20.012 1.00 0.00 C ATOM 0 H ALA A 142 14.569 -12.936 21.665 1.00 0.00 H new ATOM 0 HA ALA A 142 15.532 -13.323 18.850 1.00 0.00 H new ATOM 0 HB1 ALA A 142 16.417 -11.033 19.337 1.00 0.00 H new ATOM 0 HB2 ALA A 142 14.690 -11.118 19.760 1.00 0.00 H new ATOM 0 HB3 ALA A 142 15.925 -11.202 21.039 1.00 0.00 H new ATOM 2126 N THR A 143 18.051 -13.481 19.350 1.00 0.00 N ATOM 2127 CA THR A 143 19.417 -13.989 19.663 1.00 0.00 C ATOM 2128 C THR A 143 20.183 -12.963 20.504 1.00 0.00 C ATOM 2129 O THR A 143 19.650 -11.944 20.894 1.00 0.00 O ATOM 2130 CB THR A 143 20.090 -14.180 18.303 1.00 0.00 C ATOM 2131 OG1 THR A 143 19.094 -14.309 17.298 1.00 0.00 O ATOM 2132 CG2 THR A 143 20.954 -15.442 18.332 1.00 0.00 C ATOM 0 H THR A 143 17.932 -13.104 18.410 1.00 0.00 H new ATOM 0 HA THR A 143 19.392 -14.915 20.238 1.00 0.00 H new ATOM 0 HB THR A 143 20.719 -13.317 18.084 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.101 -13.513 16.726 1.00 0.00 H new ATOM 0 HG21 THR A 143 21.433 -15.577 17.362 1.00 0.00 H new ATOM 0 HG22 THR A 143 21.718 -15.342 19.103 1.00 0.00 H new ATOM 0 HG23 THR A 143 20.328 -16.307 18.551 1.00 0.00 H new ATOM 2140 N GLU A 144 21.429 -13.228 20.788 1.00 0.00 N ATOM 2141 CA GLU A 144 22.227 -12.269 21.605 1.00 0.00 C ATOM 2142 C GLU A 144 22.277 -10.899 20.923 1.00 0.00 C ATOM 2143 O GLU A 144 22.124 -9.873 21.557 1.00 0.00 O ATOM 2144 CB GLU A 144 23.626 -12.882 21.679 1.00 0.00 C ATOM 2145 CG GLU A 144 24.572 -11.911 22.388 1.00 0.00 C ATOM 2146 CD GLU A 144 24.416 -12.060 23.903 1.00 0.00 C ATOM 2147 OE1 GLU A 144 23.293 -12.235 24.348 1.00 0.00 O ATOM 2148 OE2 GLU A 144 25.421 -11.994 24.591 1.00 0.00 O ATOM 0 H GLU A 144 21.929 -14.066 20.490 1.00 0.00 H new ATOM 0 HA GLU A 144 21.795 -12.113 22.594 1.00 0.00 H new ATOM 0 HB2 GLU A 144 23.591 -13.830 22.216 1.00 0.00 H new ATOM 0 HB3 GLU A 144 23.994 -13.097 20.676 1.00 0.00 H new ATOM 0 HG2 GLU A 144 25.603 -12.113 22.096 1.00 0.00 H new ATOM 0 HG3 GLU A 144 24.351 -10.887 22.088 1.00 0.00 H new ATOM 2155 N GLU A 145 22.490 -10.873 19.636 1.00 0.00 N ATOM 2156 CA GLU A 145 22.551 -9.568 18.916 1.00 0.00 C ATOM 2157 C GLU A 145 21.175 -8.897 18.917 1.00 0.00 C ATOM 2158 O GLU A 145 21.054 -7.712 19.158 1.00 0.00 O ATOM 2159 CB GLU A 145 22.974 -9.921 17.490 1.00 0.00 C ATOM 2160 CG GLU A 145 22.845 -8.685 16.596 1.00 0.00 C ATOM 2161 CD GLU A 145 22.769 -9.119 15.131 1.00 0.00 C ATOM 2162 OE1 GLU A 145 22.990 -10.290 14.869 1.00 0.00 O ATOM 2163 OE2 GLU A 145 22.490 -8.274 14.297 1.00 0.00 O ATOM 0 H GLU A 145 22.624 -11.698 19.051 1.00 0.00 H new ATOM 0 HA GLU A 145 23.244 -8.870 19.386 1.00 0.00 H new ATOM 0 HB2 GLU A 145 24.003 -10.281 17.484 1.00 0.00 H new ATOM 0 HB3 GLU A 145 22.351 -10.728 17.104 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.953 -8.120 16.865 1.00 0.00 H new ATOM 0 HG3 GLU A 145 23.698 -8.024 16.746 1.00 0.00 H new ATOM 2170 N GLU A 146 20.139 -9.643 18.652 1.00 0.00 N ATOM 2171 CA GLU A 146 18.775 -9.042 18.641 1.00 0.00 C ATOM 2172 C GLU A 146 18.478 -8.402 19.997 1.00 0.00 C ATOM 2173 O GLU A 146 17.992 -7.291 20.078 1.00 0.00 O ATOM 2174 CB GLU A 146 17.828 -10.211 18.373 1.00 0.00 C ATOM 2175 CG GLU A 146 17.813 -10.524 16.876 1.00 0.00 C ATOM 2176 CD GLU A 146 19.201 -10.994 16.437 1.00 0.00 C ATOM 2177 OE1 GLU A 146 19.579 -12.092 16.810 1.00 0.00 O ATOM 2178 OE2 GLU A 146 19.864 -10.246 15.736 1.00 0.00 O ATOM 0 H GLU A 146 20.177 -10.641 18.443 1.00 0.00 H new ATOM 0 HA GLU A 146 18.669 -8.259 17.890 1.00 0.00 H new ATOM 0 HB2 GLU A 146 18.148 -11.088 18.935 1.00 0.00 H new ATOM 0 HB3 GLU A 146 16.823 -9.964 18.713 1.00 0.00 H new ATOM 0 HG2 GLU A 146 17.072 -11.295 16.663 1.00 0.00 H new ATOM 0 HG3 GLU A 146 17.522 -9.638 16.312 1.00 0.00 H new ATOM 2185 N LEU A 147 18.773 -9.092 21.064 1.00 0.00 N ATOM 2186 CA LEU A 147 18.517 -8.518 22.416 1.00 0.00 C ATOM 2187 C LEU A 147 19.540 -7.419 22.712 1.00 0.00 C ATOM 2188 O LEU A 147 19.352 -6.599 23.590 1.00 0.00 O ATOM 2189 CB LEU A 147 18.686 -9.689 23.384 1.00 0.00 C ATOM 2190 CG LEU A 147 17.333 -10.036 24.005 1.00 0.00 C ATOM 2191 CD1 LEU A 147 16.493 -10.822 22.997 1.00 0.00 C ATOM 2192 CD2 LEU A 147 17.552 -10.887 25.259 1.00 0.00 C ATOM 0 H LEU A 147 19.180 -10.027 21.059 1.00 0.00 H new ATOM 0 HA LEU A 147 17.528 -8.068 22.499 1.00 0.00 H new ATOM 0 HB2 LEU A 147 19.089 -10.554 22.858 1.00 0.00 H new ATOM 0 HB3 LEU A 147 19.401 -9.429 24.165 1.00 0.00 H new ATOM 0 HG LEU A 147 16.811 -9.118 24.273 1.00 0.00 H new ATOM 0 HD11 LEU A 147 15.529 -11.069 23.441 1.00 0.00 H new ATOM 0 HD12 LEU A 147 16.337 -10.218 22.103 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.014 -11.741 22.727 1.00 0.00 H new ATOM 0 HD21 LEU A 147 16.588 -11.135 25.703 1.00 0.00 H new ATOM 0 HD22 LEU A 147 18.074 -11.805 24.989 1.00 0.00 H new ATOM 0 HD23 LEU A 147 18.150 -10.327 25.979 1.00 0.00 H new ATOM 2204 N ALA A 148 20.621 -7.399 21.981 1.00 0.00 N ATOM 2205 CA ALA A 148 21.661 -6.355 22.210 1.00 0.00 C ATOM 2206 C ALA A 148 21.056 -4.965 22.023 1.00 0.00 C ATOM 2207 O ALA A 148 21.160 -4.107 22.877 1.00 0.00 O ATOM 2208 CB ALA A 148 22.712 -6.613 21.134 1.00 0.00 C ATOM 0 H ALA A 148 20.829 -8.061 21.234 1.00 0.00 H new ATOM 0 HA ALA A 148 22.076 -6.397 23.217 1.00 0.00 H new ATOM 0 HB1 ALA A 148 23.518 -5.885 21.231 1.00 0.00 H new ATOM 0 HB2 ALA A 148 23.115 -7.619 21.253 1.00 0.00 H new ATOM 0 HB3 ALA A 148 22.255 -6.519 20.149 1.00 0.00 H new ATOM 2214 N HIS A 149 20.427 -4.741 20.906 1.00 0.00 N ATOM 2215 CA HIS A 149 19.811 -3.410 20.646 1.00 0.00 C ATOM 2216 C HIS A 149 18.287 -3.533 20.683 1.00 0.00 C ATOM 2217 O HIS A 149 17.573 -2.550 20.682 1.00 0.00 O ATOM 2218 CB HIS A 149 20.284 -3.010 19.244 1.00 0.00 C ATOM 2219 CG HIS A 149 21.414 -3.903 18.805 1.00 0.00 C ATOM 2220 ND1 HIS A 149 22.742 -3.599 19.064 1.00 0.00 N ATOM 2221 CD2 HIS A 149 21.428 -5.094 18.121 1.00 0.00 C ATOM 2222 CE1 HIS A 149 23.492 -4.588 18.546 1.00 0.00 C ATOM 2223 NE2 HIS A 149 22.742 -5.525 17.958 1.00 0.00 N ATOM 0 H HIS A 149 20.312 -5.424 20.158 1.00 0.00 H new ATOM 0 HA HIS A 149 20.097 -2.668 21.391 1.00 0.00 H new ATOM 0 HB2 HIS A 149 19.457 -3.083 18.538 1.00 0.00 H new ATOM 0 HB3 HIS A 149 20.611 -1.970 19.245 1.00 0.00 H new ATOM 0 HD1 HIS A 149 23.087 -2.776 19.557 1.00 0.00 H new ATOM 0 HD2 HIS A 149 20.553 -5.617 17.764 1.00 0.00 H new ATOM 0 HE1 HIS A 149 24.570 -4.621 18.599 1.00 0.00 H new ATOM 2231 N GLY A 150 17.787 -4.737 20.718 1.00 0.00 N ATOM 2232 CA GLY A 150 16.310 -4.932 20.758 1.00 0.00 C ATOM 2233 C GLY A 150 15.752 -4.900 19.334 1.00 0.00 C ATOM 2234 O GLY A 150 14.989 -4.024 18.976 1.00 0.00 O ATOM 0 H GLY A 150 18.338 -5.595 20.721 1.00 0.00 H new ATOM 0 HA2 GLY A 150 16.071 -5.884 21.232 1.00 0.00 H new ATOM 0 HA3 GLY A 150 15.846 -4.151 21.360 1.00 0.00 H new ATOM 2238 N HIS A 151 16.125 -5.848 18.518 1.00 0.00 N ATOM 2239 CA HIS A 151 15.614 -5.870 17.117 1.00 0.00 C ATOM 2240 C HIS A 151 15.768 -7.269 16.519 1.00 0.00 C ATOM 2241 O HIS A 151 16.276 -8.173 17.153 1.00 0.00 O ATOM 2242 CB HIS A 151 16.486 -4.867 16.364 1.00 0.00 C ATOM 2243 CG HIS A 151 16.063 -3.467 16.716 1.00 0.00 C ATOM 2244 ND1 HIS A 151 14.948 -2.868 16.152 1.00 0.00 N ATOM 2245 CD2 HIS A 151 16.595 -2.536 17.574 1.00 0.00 C ATOM 2246 CE1 HIS A 151 14.844 -1.632 16.671 1.00 0.00 C ATOM 2247 NE2 HIS A 151 15.824 -1.378 17.544 1.00 0.00 N ATOM 0 H HIS A 151 16.761 -6.608 18.760 1.00 0.00 H new ATOM 0 HA HIS A 151 14.556 -5.616 17.059 1.00 0.00 H new ATOM 0 HB2 HIS A 151 17.535 -5.016 16.621 1.00 0.00 H new ATOM 0 HB3 HIS A 151 16.396 -5.026 15.289 1.00 0.00 H new ATOM 0 HD2 HIS A 151 17.477 -2.681 18.180 1.00 0.00 H new ATOM 0 HE1 HIS A 151 14.064 -0.930 16.414 1.00 0.00 H new ATOM 0 HE2 HIS A 151 15.974 -0.520 18.074 1.00 0.00 H new ATOM 2255 N VAL A 152 15.337 -7.456 15.302 1.00 0.00 N ATOM 2256 CA VAL A 152 15.461 -8.797 14.664 1.00 0.00 C ATOM 2257 C VAL A 152 16.087 -8.664 13.272 1.00 0.00 C ATOM 2258 O VAL A 152 15.483 -8.139 12.358 1.00 0.00 O ATOM 2259 CB VAL A 152 14.029 -9.321 14.564 1.00 0.00 C ATOM 2260 CG1 VAL A 152 13.969 -10.461 13.545 1.00 0.00 C ATOM 2261 CG2 VAL A 152 13.580 -9.838 15.932 1.00 0.00 C ATOM 0 H VAL A 152 14.904 -6.738 14.721 1.00 0.00 H new ATOM 0 HA VAL A 152 16.101 -9.470 15.235 1.00 0.00 H new ATOM 0 HB VAL A 152 13.370 -8.514 14.244 1.00 0.00 H new ATOM 0 HG11 VAL A 152 12.947 -10.833 13.475 1.00 0.00 H new ATOM 0 HG12 VAL A 152 14.289 -10.094 12.570 1.00 0.00 H new ATOM 0 HG13 VAL A 152 14.628 -11.269 13.863 1.00 0.00 H new ATOM 0 HG21 VAL A 152 12.559 -10.212 15.862 1.00 0.00 H new ATOM 0 HG22 VAL A 152 14.241 -10.644 16.251 1.00 0.00 H new ATOM 0 HG23 VAL A 152 13.620 -9.027 16.659 1.00 0.00 H new